Vitas-M small molecule compound
2-{[5-(4-tert-butylphenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2,5-dimethylphenyl)acetamide
Catalog ID
STL347059
SMILES O=C(Nc1cc(C)ccc1C)CSc1nnc(n1c1ccc(cc1)C)c1ccc(cc1)C(C)(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 C29H32N4OS MW 484.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H32N4OS/c1-19-8-15-24(16-9-19)33-27(22-11-13-23(14-12-22)29(4,5)6)31-32-28(33)35-18-26(34)30-25-17-20(2)7-10-21(25)3/h7-17H,18H2,1-6H3,(H,30,34)InChIKey
XNJARGRXWQHHPR-UHFFFAOYSA-NSynonyms
849009-74-12((5(4(tertbutyl)phenyl)4(ptolyl)4H124triazol3yl)thio)N(25dimethylphenyl)acetamide
2((5(4TERTBUTYLPHENYL)4(4METHYLPHENYL)124TRIAZOL3YL)SULFANYL)N(25DIMETHYLPHENYL)ACETAMIDE
2((5(4tertbutylphenyl)4(4methylphenyl)4H124triazol3yl)sulfanyl)N(25dimethylphenyl)acetamide
849009741
CC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)NC3=C(C=CC(=C3)C)C)C4=CC=C(C=C4)C(C)(C)C
InChI=1SC29H32N4OSc11981524(16919)3327(22111323(141222)29(45)6)313228(33)351826(34)30251720(2)71021(25)3h717H18H216H3(H3034)
MFCD05680514
ZINC000002451035
ZINC02451035
ZINC2451035
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