Vitas-M small molecule compound
1-(3,4-dimethylphenyl)-5-methyl-1H-1,2,3-triazole-4-carbothioamide
Catalog ID
STL102674
SMILES NC(=S)c1nnn(c1C)c1ccc(c(c1)C)C
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C12H14N4S MW 246.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H14N4S/c1-7-4-5-10(6-8(7)2)16-9(3)11(12(13)17)14-15-16/h4-6H,1-3H3,(H2,13,17)InChIKey
JIXWUZLYITWZMW-UHFFFAOYSA-NSynonyms
1239788-27-21(34DIMETHYLPHENYL)5METHYL1H(123)TRIAZOLE4CARBOTHIOICACIDAMIDE
1(34dimethylphenyl)5methyl1H123triazole4carbothioamide
1(34dimethylphenyl)5methyltriazole4carbothioamide
1239788272
CC1=C(C=C(C=C1)N2C(=C(N=N2)C(=S)N)C)C
InChI=1SC12H14N4Sc174510(68(7)2)169(3)11(12(13)17)141516h46H13H3(H21317)
MFCD14703534
ZINC000045918739
ZINC45918739
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