Vitas-M small molecule compound

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

Catalog ID
STK567449
SMILES CCOc1ccc(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 C24H20ClN3O4S MW 481.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H20ClN3O4S/c1-2-32-19-10-8-18(9-11-19)28-23(15-3-6-17(25)7-4-15)26-27-24(28)33-14-22(31)16-5-12-20(29)21(30)13-16/h3-13,29-30H,2,14H2,1H3
InChIKey
JYNJCMHZLRSSBA-UHFFFAOYSA-N
Synonyms
714938-32-6
1(34DIHYDROXYPHENYL)2(5(4CHLOROPHENYL)4(4ETHOXYPHENYL)(124TRIAZOL3YLTHIO))ETHAN1ONE
2((5(4CHLOROPHENYL)4(4ETHOXYPHENYL)124TRIAZOL3YL)SULFANYL)1(34DIHYDROXYPHENYL)ETHANONE
2((5(4CHLOROPHENYL)4(4ETHOXYPHENYL)4H124TRIAZOL3YL)SULFANYL)1(34DIHYDROXYPHENYL)ETHAN1ONE
2((5(4chlorophenyl)4(4ethoxyphenyl)4H124triazol3yl)sulfanyl)1(34dihydroxyphenyl)ethanone
2((5(4chlorophenyl)4(4ethoxyphenyl)4H124triazol3yl)thio)1(34dihydroxyphenyl)ethanone
714938326
CCOC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)C3=CC(=C(C=C3)O)O)C4=CC=C(C=C4)Cl
InChI=1SC24H20ClN3O4Sc12321910818(91119)2823(153617(25)7415)262724(28)331422(31)1651220(29)21(30)1316h3132930H214H21H3
MFCD05678400
ZINC000001276438
ZINC01276438
ZINC1276438

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Available files

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