Vitas-M small molecule compound
methyl 2-{(3E)-3-[hydroxy(phenyl)methylidene]-4,5-dioxo-2-phenylpyrrolidin-1-yl}-4-methyl-1,3-thiazole-5-carboxylate
Catalog ID
STK853976
SMILES COC(=O)c1sc(nc1C)N1C(c2ccccc2)/C(=C(/c2ccccc2)\O)/C(=O)C1=O
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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 C23H18N2O5S MW 434.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H18N2O5S/c1-13-20(22(29)30-2)31-23(24-13)25-17(14-9-5-3-6-10-14)16(19(27)21(25)28)18(26)15-11-7-4-8-12-15/h3-12,17,26H,1-2H3/b18-16+InChIKey
PIZHOKQIGAEZIY-FBMGVBCBSA-NSynonyms
CC1=C(SC(=N1)N2C(C(=C(C3=CC=CC=C3)O)C(=O)C2=O)C4=CC=CC=C4)C(=O)OC
COC(=O)c1sc(nc1C)N1C(c2ccccc2)C(=C(c2ccccc2)O)C(=O)C1=O
InChI=1SC23H18N2O5Sc11320(22(29)302)3123(2413)2517(1495361014)16(19(27)21(25)28)18(26)15117481215h3121726H12H3b1816+
methyl2((3E)3(hydroxy(phenyl)methylidene)45dioxo2phenylpyrrolidin1yl)4methyl13thiazole5carboxylate
METHYL2((4E)4(HYDROXY(PHENYL)METHYLIDENE)23DIOXO5PHENYLPYRROLIDIN1YL)4METHYL13THIAZOLE5CARBOXYLATE
METHYL2(3HYDROXY2OXO5PHENYL4(PHENYLCARBONYL)(3PYRROLINYL))4METHYL13THIAZOLE5CARBOXYLATE
MFCD08735766
ZINC000102803590
ZINC000102803594
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