Vitas-M small molecule compound
2-{[5-(4-tert-butylphenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-chlorophenyl)acetamide
Catalog ID
STL299198
SMILES O=C(Nc1ccc(cc1)Cl)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 C27H27ClN4OS MW 491.06 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H27ClN4OS/c1-18-5-15-23(16-6-18)32-25(19-7-9-20(10-8-19)27(2,3)4)30-31-26(32)34-17-24(33)29-22-13-11-21(28)12-14-22/h5-16H,17H2,1-4H3,(H,29,33)InChIKey
MLWSYATYWUFQQG-UHFFFAOYSA-NSynonyms
849029-42-12((5(4(tertbutyl)phenyl)4(ptolyl)4H124triazol3yl)thio)N(4chlorophenyl)acetamide
2((5(4TERTBUTYLPHENYL)4(4METHYLPHENYL)124TRIAZOL3YL)SULFANYL)N(4CHLOROPHENYL)ACETAMIDE
2((5(4tertbutylphenyl)4(4methylphenyl)4H124triazol3yl)sulfanyl)N(4chlorophenyl)acetamide
2(5(4(TERTBUTYL)PHENYL)4(4METHYLPHENYL)(124TRIAZOL3YLTHIO))N(4CHLOROPHENYL)ACETAMIDE
849029421
CC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)NC3=CC=C(C=C3)Cl)C4=CC=C(C=C4)C(C)(C)C
InChI=1SC27H27ClN4OSc11851523(16618)3225(197920(10819)27(23)4)303126(32)341724(33)2922131121(28)121422h516H17H214H3(H2933)
MFCD05681753
ZINC000002454011
ZINC02454011
ZINC2454011
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