Vitas-M small molecule compound

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

Catalog ID
STK573266
SMILES Cc1ccc(cc1)n1c(SCC(=O)c2ccc(cc2)Cl)nnc1COc1ccccc1

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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 C24H20ClN3O2S MW 449.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H20ClN3O2S/c1-17-7-13-20(14-8-17)28-23(15-30-21-5-3-2-4-6-21)26-27-24(28)31-16-22(29)18-9-11-19(25)12-10-18/h2-14H,15-16H2,1H3
InChIKey
YXTJWSKQPZNHRO-UHFFFAOYSA-N
Synonyms
537703-24-5
1(4CHLOROPHENYL)2((4(4METHYLPHENYL)5(PHENOXYMETHYL)124TRIAZOL3YL)SULFANYL)ETHANONE
1(4CHLOROPHENYL)2((4(4METHYLPHENYL)5(PHENOXYMETHYL)4H124TRIAZOL3YL)SULFANYL)ETHAN1ONE
1(4chlorophenyl)2((4(4methylphenyl)5(phenoxymethyl)4H124triazol3yl)sulfanyl)ethanone
1(4chlorophenyl)2((5(phenoxymethyl)4(ptolyl)4H124triazol3yl)thio)ethanone
1(4CHLOROPHENYL)2(4(4METHYLPHENYL)5(PHENOXYMETHYL)(124TRIAZOL3YLTHIO))ETHAN1ONE
537703245
CC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)C3=CC=C(C=C3)Cl)COC4=CC=CC=C4
InChI=1SC24H20ClN3O2Sc11771320(14817)2823(1530215324621)262724(28)311622(29)1891119(25)121018h214H1516H21H3
MFCD03459775
ZINC000002354320
ZINC02354320
ZINC2354320

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Available files

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