Vitas-M small molecule compound

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

Catalog ID
STL053271
SMILES Clc1ccc(cc1)c1nnc(n1c1ccccc1)SCC(=O)c1ccc(c(c1)O)O

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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 C22H16ClN3O3S MW 437.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H16ClN3O3S/c23-16-9-6-14(7-10-16)21-24-25-22(26(21)17-4-2-1-3-5-17)30-13-20(29)15-8-11-18(27)19(28)12-15/h1-12,27-28H,13H2
InChIKey
OAZGQPCGRCLPNM-UHFFFAOYSA-N
Synonyms
714284-25-0
1(34DIHYDROXYPHENYL)2(5(4CHLOROPHENYL)4PHENYL(124TRIAZOL3YLTHIO))ETHAN1ONE
2((5(4CHLOROPHENYL)4PHENYL124TRIAZOL3YL)SULFANYL)1(34DIHYDROXYPHENYL)ETHANONE
2((5(4CHLOROPHENYL)4PHENYL4H124TRIAZOL3YL)SULFANYL)1(34DIHYDROXYPHENYL)ETHAN1ONE
2((5(4chlorophenyl)4phenyl4H124triazol3yl)sulfanyl)1(34dihydroxyphenyl)ethanone
2((5(4chlorophenyl)4phenyl4H124triazol3yl)thio)1(34dihydroxyphenyl)ethanone
2(5(4CHLOROPHENYL)4PHENYL4H124TRIAZOL3YLTHIO)1(34DIHYDROXYPHENYL)ETHANONE
714284250
C1=CC=C(C=C1)N2C(=NN=C2SCC(=O)C3=CC(=C(C=C3)O)O)C4=CC=C(C=C4)Cl
InChI=1SC22H16ClN3O3Sc23169614(71016)21242522(26(21)174213517)301320(29)1581118(27)19(28)1215h1122728H13H2
MFCD05686816
ZINC000001292350
ZINC01292350
ZINC1292350

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Available files

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