Vitas-M small molecule compound
1-(4-chlorophenyl)-2-{[5-(3,4-dimethoxyphenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}ethanone
Catalog ID
STK804071
SMILES COc1cc(ccc1OC)c1nnc(n1C)SCC(=O)c1ccc(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 C19H18ClN3O3S MW 403.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18ClN3O3S/c1-23-18(13-6-9-16(25-2)17(10-13)26-3)21-22-19(23)27-11-15(24)12-4-7-14(20)8-5-12/h4-10H,11H2,1-3H3InChIKey
IRJNUIKVQNZWDW-UHFFFAOYSA-NSynonyms
1(4CHLOROPHENYL)2((5(34DIMETHOXYPHENYL)4METHYL124TRIAZOL3YL)SULFANYL)ETHANONE
1(4chlorophenyl)2((5(34dimethoxyphenyl)4methyl4H124triazol3yl)sulfanyl)ethanone
2(5(34DIMETHOXYPHENYL)4METHYL(124TRIAZOL3YLTHIO))1(4CHLOROPHENYL)ETHAN1ONE
CN1C(=NN=C1SCC(=O)C2=CC=C(C=C2)Cl)C3=CC(=C(C=C3)OC)OC
InChI=1SC19H18ClN3O3Sc12318(136916(252)17(1013)263)212219(23)271115(24)124714(20)8512h410H11H213H3
MFCD04065548
ZINC000000936552
ZINC00936552
ZINC936552
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