Vitas-M small molecule compound
(2E)-1-[5-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-3-(4-methoxyphenyl)-1H-1,2,4-triazol-1-yl]-3-(4-methoxyphenyl)prop-2-en-1-one
Catalog ID
STK807805
SMILES COc1ccc(cc1)c1nn(c(n1)SCC(=O)c1ccc(cc1)Cl)C(=O)/C=C/c1ccc(cc1)OC
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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 C27H22ClN3O4S MW 520.01 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H22ClN3O4S/c1-34-22-12-3-18(4-13-22)5-16-25(33)31-27(36-17-24(32)19-6-10-21(28)11-7-19)29-26(30-31)20-8-14-23(35-2)15-9-20/h3-16H,17H2,1-2H3/b16-5+InChIKey
BSYAHMHEQLODDC-FZSIALSZSA-NSynonyms
877818-55-8(2E)1(5((2(4chlorophenyl)2oxoethyl)sulfanyl)3(4methoxyphenyl)1H124triazol1yl)3(4methoxyphenyl)prop2en1one
(2E)1(5(2(4CHLOROPHENYL)2OXOETHYLTHIO)3(4METHOXYPHENYL)(124TRIAZOLYL))3(4METHOXYPHENYL)PROP2EN1ONE
(E)1(5(2(4chlorophenyl)2oxoethyl)sulfanyl3(4methoxyphenyl)124triazol1yl)3(4methoxyphenyl)prop2en1one
877818558
COC1=CC=C(C=C1)C=CC(=O)N2C(=NC(=N2)C3=CC=C(C=C3)OC)SCC(=O)C4=CC=C(C=C4)Cl
COc1ccc(cc1)c1nn(c(n1)SCC(=O)c1ccc(cc1)Cl)C(=O)C=Cc1ccc(cc1)OC
InChI=1SC27H22ClN3O4Sc1342212318(41322)51625(33)3127(361724(32)1961021(28)11719)2926(3031)2081423(352)15920h316H17H212H3b165+
MFCD06407503
ZINC000010381765
ZINC10381765
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