4-Amino-5-methyl-1,2,4-triazole-3-thione derivative of 4-[2-(2 hydroxyethyl)methylamino]benzaldehyde

Ji Wu; Yu-Peng Tian; Fu-Xin Xie; Suchada Chantrapromma; Hoong-Kun Fun; Ibrahim Abdul Razak

doi:10.1107/s1600536801007851

4-Amino-5-methyl-1,2,4-triazole-3-thione derivative of 4-[2-(2 hydroxyethyl)methylamino]benzaldehyde

Ji Wu
, Yu-Peng Tian
, Fu-Xin Xie
, Suchada Chantrapromma
, Hoong-Kun Fun
, Ibrahim Abdul Razak

Biochemistry, Chemistry & Physics

Anhui University

Research output: Contribution to journal › Article › peer-review

Abstract

The title compound, 4-{4-[2-(2-hydroxyethyl)methylamino]benzylideneamino}-5-methyl-1,2,4-triazole-3-thione, C13H17N5OS, is present in a thioketone form and the triazole ring is almost planar. The asymmetric unit consists of two molecules which have different conformations. There is a weak C-H...S intramolecular interaction, a weak O-H...S intermolecular interaction and intermolecular N-H...O and O-H...N hydrogen bonds.

Original language	American English
Pages (from-to)	o547-o549
Journal	Acta Crystallographica, Section E
Volume	57
Issue number	6
DOIs	https://doi.org/10.1107/s1600536801007851
State	Published - May 31 2001

Disciplines

Chemistry

Keywords

2
4-Amino-5-methyl-1
4-[2-(2 hydroxyethyl)methylamino]benzaldehyde
4-triazole-3-thione derivative

Access to Document

10.1107/s1600536801007851

Cite this

@article{2402ccbcf7454349993c4a1c5a35f619,

title = "4-Amino-5-methyl-1,2,4-triazole-3-thione derivative of 4-[2-(2 hydroxyethyl)methylamino]benzaldehyde",

abstract = " The title compound, 4-\{4-[2-(2-hydroxyethyl)methylamino]benzylideneamino\}-5-methyl-1,2,4-triazole-3-thione, C13H17N5OS, is present in a thioketone form and the triazole ring is almost planar. The asymmetric unit consists of two molecules which have different conformations. There is a weak C-H...S intramolecular interaction, a weak O-H...S intermolecular interaction and intermolecular N-H...O and O-H...N hydrogen bonds.",

keywords = "2, 4-Amino-5-methyl-1, 4-[2-(2 hydroxyethyl)methylamino]benzaldehyde, 4-triazole-3-thione derivative",

author = "Ji Wu and Yu-Peng Tian and Fu-Xin Xie and Suchada Chantrapromma and Hoong-Kun Fun and Razak, \{Ibrahim Abdul\}",

note = "Refinement. Refinement of F 2 against ALL reflections. The weighted R-factor wR and goodness of fit S are based on F 2, conventional R-factors R are based on F, with F set to zero for negative F 2. The threshold expression of F 2 > σ( F 2) is used only for calculating R-factors(gt) etc.",

year = "2001",

month = may,

day = "31",

doi = "10.1107/s1600536801007851",

language = "American English",

volume = "57",

pages = "o547--o549",

journal = "Acta Crystallographica, Section E",

number = "6",

}

TY - JOUR

T1 - 4-Amino-5-methyl-1,2,4-triazole-3-thione derivative of 4-[2-(2 hydroxyethyl)methylamino]benzaldehyde

AU - Wu, Ji

AU - Tian, Yu-Peng

AU - Xie, Fu-Xin

AU - Chantrapromma, Suchada

AU - Fun, Hoong-Kun

AU - Razak, Ibrahim Abdul

N1 - Refinement. Refinement of F 2 against ALL reflections. The weighted R-factor wR and goodness of fit S are based on F 2, conventional R-factors R are based on F, with F set to zero for negative F 2. The threshold expression of F 2 > σ( F 2) is used only for calculating R-factors(gt) etc.

PY - 2001/5/31

Y1 - 2001/5/31

N2 - The title compound, 4-{4-[2-(2-hydroxyethyl)methylamino]benzylideneamino}-5-methyl-1,2,4-triazole-3-thione, C13H17N5OS, is present in a thioketone form and the triazole ring is almost planar. The asymmetric unit consists of two molecules which have different conformations. There is a weak C-H...S intramolecular interaction, a weak O-H...S intermolecular interaction and intermolecular N-H...O and O-H...N hydrogen bonds.

AB - The title compound, 4-{4-[2-(2-hydroxyethyl)methylamino]benzylideneamino}-5-methyl-1,2,4-triazole-3-thione, C13H17N5OS, is present in a thioketone form and the triazole ring is almost planar. The asymmetric unit consists of two molecules which have different conformations. There is a weak C-H...S intramolecular interaction, a weak O-H...S intermolecular interaction and intermolecular N-H...O and O-H...N hydrogen bonds.

KW - 2

KW - 4-Amino-5-methyl-1

KW - 4-[2-(2 hydroxyethyl)methylamino]benzaldehyde

KW - 4-triazole-3-thione derivative

UR - https://doi.org/10.1107/S1600536801007851

UR - https://www.mendeley.com/catalogue/e7c779e0-3dd8-3a81-8563-558c0f421a97/

U2 - 10.1107/s1600536801007851

DO - 10.1107/s1600536801007851

M3 - Article

VL - 57

SP - o547-o549

JO - Acta Crystallographica, Section E

JF - Acta Crystallographica, Section E

IS - 6

ER -

4-Amino-5-methyl-1,2,4-triazole-3-thione derivative of 4-[2-(2 hydroxyethyl)methylamino]benzaldehyde

Abstract

Disciplines

Keywords

Access to Document

Other files and links

Fingerprint

Cite this