Vitas-M small molecule compound

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

Catalog ID
STL054491
SMILES COc1ccc(cc1)n1c(SCC(=O)Nc2ccc(cc2)NC(=O)C)nnc1c1ccc(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 C25H22ClN5O3S MW 508.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22ClN5O3S/c1-16(32)27-19-7-9-20(10-8-19)28-23(33)15-35-25-30-29-24(17-3-5-18(26)6-4-17)31(25)21-11-13-22(34-2)14-12-21/h3-14H,15H2,1-2H3,(H,27,32)(H,28,33)
InChIKey
RSJAZEAHNJTJET-UHFFFAOYSA-N
Synonyms
849002-83-1
2((5(4CHLOROPHENYL)4(4METHOXYPHENYL)4H124TRIAZOL3YL)SULFANYL)N(4ACETAMIDOPHENYL)ACETAMIDE
849002831
CC(=O)NC1=CC=C(C=C1)NC(=O)CSC2=NN=C(N2C3=CC=C(C=C3)OC)C4=CC=C(C=C4)Cl
InChI=1SC25H22ClN5O3Sc116(32)27197920(10819)2823(33)153525302924(173518(26)6417)31(25)21111322(342)141221h314H15H212H3(H2732)(H2833)
MFCD04852453
N(4(acetylamino)phenyl)2((5(4chlorophenyl)4(4methoxyphenyl)4H124triazol3yl)sulfanyl)acetamide
N(4(ACETYLAMINO)PHENYL)2(5(4CHLOROPHENYL)4(4METHOXYPHENYL)(124TRIAZOL3YLTHIO))ACETAMIDE
N(4ACETAMIDOPHENYL)2((5(4CHLOROPHENYL)4(4METHOXYPHENYL)124TRIAZOL3YL)SULFANYL)ACETAMIDE
N(4acetamidophenyl)2((5(4chlorophenyl)4(4methoxyphenyl)4H124triazol3yl)thio)acetamide
ZINC000002450357
ZINC02450357
ZINC2450357

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Available files

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