Vitas-M small molecule compound
2-{[5-(4-tert-butylphenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2,5-dichlorophenyl)acetamide
Catalog ID
STL348347
SMILES O=C(Nc1cc(Cl)ccc1Cl)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 C27H26Cl2N4OS MW 525.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H26Cl2N4OS/c1-17-5-12-21(13-6-17)33-25(18-7-9-19(10-8-18)27(2,3)4)31-32-26(33)35-16-24(34)30-23-15-20(28)11-14-22(23)29/h5-15H,16H2,1-4H3,(H,30,34)InChIKey
FDXBZPWPNXXAJU-UHFFFAOYSA-NSynonyms
862118-08-92((5(4(tertbutyl)phenyl)4(ptolyl)4H124triazol3yl)thio)N(25dichlorophenyl)acetamide
2((5(4TERTBUTYLPHENYL)4(4METHYLPHENYL)124TRIAZOL3YL)SULFANYL)N(25DICHLOROPHENYL)ACETAMIDE
2((5(4tertbutylphenyl)4(4methylphenyl)4H124triazol3yl)sulfanyl)N(25dichlorophenyl)acetamide
862118089
CC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)NC3=C(C=CC(=C3)Cl)Cl)C4=CC=C(C=C4)C(C)(C)C
InChI=1SC27H26Cl2N4OSc11751221(13617)3325(187919(10818)27(23)4)313226(33)351624(34)30231520(28)111422(23)29h515H16H214H3(H3034)
MFCD05687272
ZINC000009309432
ZINC09309432
ZINC9309432
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