Vitas-M small molecule compound

2-{[5-(4-chlorophenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(3,4-dihydroxyphenyl)ethanone

Catalog ID
STK568608
SMILES Cc1ccc(cc1)n1c(SCC(=O)c2ccc(c(c2)O)O)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 C23H18ClN3O3S MW 451.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H18ClN3O3S/c1-14-2-9-18(10-3-14)27-22(15-4-7-17(24)8-5-15)25-26-23(27)31-13-21(30)16-6-11-19(28)20(29)12-16/h2-12,28-29H,13H2,1H3
InChIKey
PNVBTIVMIKZZBY-UHFFFAOYSA-N
Synonyms
714287-49-7
1(34DIHYDROXYPHENYL)2(5(4CHLOROPHENYL)4(4METHYLPHENYL)(124TRIAZOL3YLTHIO))ETHAN1ONE
2((5(4CHLOROPHENYL)4(4METHYLPHENYL)124TRIAZOL3YL)SULFANYL)1(34DIHYDROXYPHENYL)ETHANONE
2((5(4chlorophenyl)4(4methylphenyl)4H124triazol3yl)sulfanyl)1(34dihydroxyphenyl)ethanone
2((5(4chlorophenyl)4(ptolyl)4H124triazol3yl)thio)1(34dihydroxyphenyl)ethanone
714287497
CC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)C3=CC(=C(C=C3)O)O)C4=CC=C(C=C4)Cl
InChI=1SC23H18ClN3O3Sc1142918(10314)2722(154717(24)8515)252623(27)311321(30)1661119(28)20(29)1216h2122829H13H21H3
MFCD03223583
ZINC000002596377
ZINC02596377
ZINC2596377

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Available files

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