Vitas-M small molecule compound
2-{[5-(4-tert-butylphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(5-chloro-2-methylphenyl)acetamide
Catalog ID
STK733147
SMILES O=C(Nc1cc(Cl)ccc1C)CSc1nnc(n1c1ccccc1)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/c1-18-10-15-21(28)16-23(18)29-24(33)17-34-26-31-30-25(32(26)22-8-6-5-7-9-22)19-11-13-20(14-12-19)27(2,3)4/h5-16H,17H2,1-4H3,(H,29,33)InChIKey
LLIGDSPROCJYSL-UHFFFAOYSA-NSynonyms
312503-24-52((5(4(tertbutyl)phenyl)4phenyl4H124triazol3yl)thio)N(5chloro2methylphenyl)acetamide
2((5(4TERTBUTYLPHENYL)4PHENYL124TRIAZOL3YL)SULFANYL)N(5CHLORO2METHYLPHENYL)ACETAMIDE
2((5(4tertbutylphenyl)4phenyl4H124triazol3yl)sulfanyl)N(5chloro2methylphenyl)acetamide
312503245
CC1=C(C=C(C=C1)Cl)NC(=O)CSC2=NN=C(N2C3=CC=CC=C3)C4=CC=C(C=C4)C(C)(C)C
InChI=1SC27H27ClN4OSc118101521(28)1623(18)2924(33)173426313025(32(26)228657922)19111320(141219)27(23)4h516H17H214H3(H2933)
MFCD01204102
ZINC000002351678
ZINC02351678
ZINC2351678
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