Vitas-M small molecule compound
4-{5-[(Z)-(3-{2-[(3-chlorophenyl)amino]-2-oxoethyl}-2,4-dioxo-1,3-thiazolidin-5-ylidene)methyl]furan-2-yl}-3-methylbenzoic acid
Catalog ID
STK201838
SMILES O=C(CN1C(=O)S/C(=C\c2ccc(o2)c2ccc(cc2C)C(=O)O)/C1=O)Nc1cccc(c1)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 C24H17ClN2O6S MW 496.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H17ClN2O6S/c1-13-9-14(23(30)31)5-7-18(13)19-8-6-17(33-19)11-20-22(29)27(24(32)34-20)12-21(28)26-16-4-2-3-15(25)10-16/h2-11H,12H2,1H3,(H,26,28)(H,30,31)/b20-11-InChIKey
KXASFDRUZPWWOG-JAIQZWGSSA-NSynonyms
4(5((Z)(3(2((3chlorophenyl)amino)2oxoethyl)24dioxo13thiazolidin5ylidene)methyl)furan2yl)3methylbenzoicacid
4(5((Z)(3(2(3chloroanilino)2oxoethyl)24dioxo13thiazolidin5ylidene)methyl)furan2yl)3methylbenzoicacid
CC1=C(C=CC(=C1)C(=O)O)C2=CC=C(O2)C=C3C(=O)N(C(=O)S3)CC(=O)NC4=CC(=CC=C4)Cl
InChI=1SC24H17ClN2O6Sc113914(23(30)31)5718(13)198617(3319)112022(29)27(24(32)3420)1221(28)261642315(25)1016h211H12H21H3(H2628)(H3031)b2011
MFCD07143163
O=C(CN1C(=O)SC(=Cc2ccc(o2)c2ccc(cc2C)C(=O)O)C1=O)Nc1cccc(c1)Cl
ZINC000012393111
ZINC12393111
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