Vitas-M small molecule compound
5-benzyl-4-(3,4-dimethylphenyl)-4H-1,2,4-triazole-3-thiol
Catalog ID
STL381295
SMILES Cc1ccc(cc1C)n1c(S)nnc1Cc1ccccc1
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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 C17H17N3S MW 295.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17N3S/c1-12-8-9-15(10-13(12)2)20-16(18-19-17(20)21)11-14-6-4-3-5-7-14/h3-10H,11H2,1-2H3,(H,19,21)InChIKey
DVANCPCATXKJQI-UHFFFAOYSA-NSynonyms
84382-17-23BENZYL4(34DIMETHYLPHENYL)1H124TRIAZOLE5THIONE
5benzyl4(34dimethylphenyl)4H124triazole3thiol
84382172
CC1=C(C=C(C=C1)N2C(=NNC2=S)CC3=CC=CC=C3)C
InChI=1SC17H17N3Sc1128915(1013(12)2)2016(181917(20)21)11146435714h310H11H212H3(H1921)
MFCD05134120
ZINC000005926666
ZINC05926666
ZINC5926666
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