Vitas-M small molecule compound
2-{[5-(4-tert-butylphenyl)-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-chloro-2-methylphenyl)acetamide
Catalog ID
STK093109
SMILES COc1ccc(cc1)n1c(SCC(=O)Nc2ccc(cc2C)Cl)nnc1c1ccc(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 C28H29ClN4O2S MW 521.08 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H29ClN4O2S/c1-18-16-21(29)10-15-24(18)30-25(34)17-36-27-32-31-26(19-6-8-20(9-7-19)28(2,3)4)33(27)22-11-13-23(35-5)14-12-22/h6-16H,17H2,1-5H3,(H,30,34)InChIKey
NWNGDTMKQQLHLJ-UHFFFAOYSA-NSynonyms
477313-66-92((5(4(TERTBUTYL)PHENYL)4(4METHOXYPHENYL)4H124TRIAZOL3YL)THIO)N(4CHLORO2METHYLPHENYL)ACETAMIDE
2((5(4TERTBUTYLPHENYL)4(4METHOXYPHENYL)124TRIAZOL3YL)SULFANYL)N(4CHLORO2METHYLPHENYL)ACETAMIDE
2((5(4TERTBUTYLPHENYL)4(4METHOXYPHENYL)4H124TRIAZOL3YL)SULFANYL)N(4CHLORO2METHYLPHENYL)ACETAMIDE
2(5(4(TERTBUTYL)PHENYL)4(4METHOXYPHENYL)(124TRIAZOL3YLTHIO))N(4CHLORO2METHYLPHENYL)ACETAMIDE
477313669
CC1=C(C=CC(=C1)Cl)NC(=O)CSC2=NN=C(N2C3=CC=C(C=C3)OC)C4=CC=C(C=C4)C(C)(C)C
COc1ccc(cc1)n1c(SCC(=O)Nc2ccc(cc2C)Cl)nnc1c1ccc(cc1)C(C)(C)C
InChI=1SC28H29ClN4O2Sc1181621(29)101524(18)3025(34)173627323126(196820(9719)28(23)4)33(27)22111323(355)141222h616H17H215H3(H3034)
MFCD03474132
STK093109
ZINC000002261848
ZINC02261848
ZINC2261848
Check stock
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Check stock on Vitas-MAvailable files
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