Vitas-M small molecule compound
4-benzyl-5-[2-(4-methylphenyl)cyclopropyl]-4H-1,2,4-triazole-3-thiol
Catalog ID
STK965969
SMILES Cc1ccc(cc1)C1CC1c1nnc(n1Cc1ccccc1)S
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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 C19H19N3S MW 321.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19N3S/c1-13-7-9-15(10-8-13)16-11-17(16)18-20-21-19(23)22(18)12-14-5-3-2-4-6-14/h2-10,16-17H,11-12H2,1H3,(H,21,23)InChIKey
BAFJXKRILKTZMP-UHFFFAOYSA-NSynonyms
512818-30-34BENZYL3(2(4METHYLPHENYL)CYCLOPROPYL)1H124TRIAZOLE5THIONE
4BENZYL5(2(4METHYLPHENYL)CYCLOPROPYL)4H124TRIAZOL3YLHYDROSULFIDE
4benzyl5(2(4methylphenyl)cyclopropyl)4H124triazole3thiol
512818303
CC1=CC=C(C=C1)C2CC2C3=NNC(=S)N3CC4=CC=CC=C4
InChI=1SC19H19N3Sc1137915(10813)161117(16)18202119(23)22(18)12145324614h2101617H1112H21H3(H2123)
MFCD03468287
ZINC000006556796
ZINC000006556802
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