Vitas-M small molecule compound
4-(4-methoxyphenyl)-2-oxo-1,3-benzoxathiol-5-yl (2E)-3-(4-chlorophenyl)prop-2-enoate
Catalog ID
STK533014
SMILES COc1ccc(cc1)c1c(ccc2c1sc(=O)o2)OC(=O)/C=C/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 C23H15ClO5S MW 438.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H15ClO5S/c1-27-17-9-5-15(6-10-17)21-18(11-12-19-22(21)30-23(26)29-19)28-20(25)13-4-14-2-7-16(24)8-3-14/h2-13H,1H3/b13-4+InChIKey
QKYGJNZHLYERNF-YIXHJXPBSA-NSynonyms
(4(4METHOXYPHENYL)2OXO13BENZOXATHIOL5YL)(E)3(4CHLOROPHENYL)PROP2ENOATE
(E)4(4methoxyphenyl)2oxobenzo(d)(13)oxathiol5yl3(4chlorophenyl)acrylate
4(4methoxyphenyl)2oxo13benzoxathiol5yl(2E)3(4chlorophenyl)prop2enoate
COC1=CC=C(C=C1)C2=C(C=CC3=C2SC(=O)O3)OC(=O)C=CC4=CC=C(C=C4)Cl
COc1ccc(cc1)c1c(ccc2c1sc(=O)o2)OC(=O)C=Cc1ccc(cc1)Cl
InChI=1SC23H15ClO5Sc127179515(61017)2118(11121922(21)3023(26)2919)2820(25)134142716(24)8314h213H1H3b134+
MFCD02985072
ZINC000001814581
ZINC01814581
ZINC1814581
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