Vitas-M small molecule compound

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

Catalog ID
STK099645
SMILES COc1ccc(cc1)c1nnc(n1c1ccc(cc1)Cl)SCC(=O)Nc1ccc(cc1)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 C24H21ClN4O2S MW 464.98 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H21ClN4O2S/c1-16-3-9-19(10-4-16)26-22(30)15-32-24-28-27-23(17-5-13-21(31-2)14-6-17)29(24)20-11-7-18(25)8-12-20/h3-14H,15H2,1-2H3,(H,26,30)
InChIKey
FXJZMMGPWMRKKG-UHFFFAOYSA-N
Synonyms
499101-50-7
2((4(4CHLOROPHENYL)5(4METHOXYPHENYL)124TRIAZOL3YL)SULFANYL)N(4METHYLPHENYL)ACETAMIDE
2((4(4CHLOROPHENYL)5(4METHOXYPHENYL)4H124TRIAZOL3YL)SULFANYL)N(4METHYLPHENYL)ACETAMIDE
2((4(4chlorophenyl)5(4methoxyphenyl)4H124triazol3yl)thio)N(ptolyl)acetamide
2(4(4CHLOROPHENYL)5(4METHOXYPHENYL)(124TRIAZOL3YLTHIO))N(4METHYLPHENYL)ACETAMIDE
499101507
CC1=CC=C(C=C1)NC(=O)CSC2=NN=C(N2C3=CC=C(C=C3)Cl)C4=CC=C(C=C4)OC
COc1ccc(cc1)c1nnc(n1c1ccc(cc1)Cl)SCC(=O)Nc1ccc(cc1)C
InChI=1SC24H21ClN4O2Sc1163919(10416)2622(30)153224282723(1751321(312)14617)29(24)2011718(25)81220h314H15H212H3(H2630)
MFCD03223244
STK099645
ZINC000000634654
ZINC00634654
ZINC634654

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.