Vitas-M small molecule compound

2-({5-[(4-chlorophenoxy)methyl]-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(2-ethyl-6-methylphenyl)acetamide

Catalog ID
STK584041
SMILES COc1ccc(cc1)n1c(SCC(=O)Nc2c(C)cccc2CC)nnc1COc1ccc(cc1)Cl

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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 C27H27ClN4O3S MW 523.06 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H27ClN4O3S/c1-4-19-7-5-6-18(2)26(19)29-25(33)17-36-27-31-30-24(16-35-23-12-8-20(28)9-13-23)32(27)21-10-14-22(34-3)15-11-21/h5-15H,4,16-17H2,1-3H3,(H,29,33)
InChIKey
ZXYHBEKCJJIBFO-UHFFFAOYSA-N
Synonyms
848924-44-7
2((5((4CHLOROPHENOXY)METHYL)4(4METHOXYPHENYL)124TRIAZOL3YL)SULFANYL)N(2ETHYL6METHYLPHENYL)ACETAMIDE
2((5((4chlorophenoxy)methyl)4(4methoxyphenyl)4H124triazol3yl)sulfanyl)N(2ethyl6methylphenyl)acetamide
2((5((4chlorophenoxy)methyl)4(4methoxyphenyl)4H124triazol3yl)thio)N(2ethyl6methylphenyl)acetamide
2((5(4CHLOROPHENOXYMETHYL)4(4METHOXYPHENYL)4H124TRIAZOL3YL)SULFANYL)N(2ETHYL6METHYLPHENYL)ACETAMIDE
2(5((4CHLOROPHENOXY)METHYL)4(4METHOXYPHENYL)(124TRIAZOL3YLTHIO))N(6ETHYL2METHYLPHENYL)ACETAMIDE
848924447
CCC1=CC=CC(=C1NC(=O)CSC2=NN=C(N2C3=CC=C(C=C3)OC)COC4=CC=C(C=C4)Cl)C
InChI=1SC27H27ClN4O3Sc141975618(2)26(19)2925(33)173627313024(16352312820(28)91323)32(27)21101422(343)151121h515H41617H213H3(H2933)
MFCD05677803
ZINC000002443528
ZINC02443528
ZINC2443528

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Available files

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