Vitas-M small molecule compound
methyl 2-{(3E)-3-[(4-fluorophenyl)(hydroxy)methylidene]-4,5-dioxo-2-[4-(propan-2-yl)phenyl]pyrrolidin-1-yl}-4-methyl-1,3-thiazole-5-carboxylate
Catalog ID
STK606809
SMILES COC(=O)c1sc(nc1C)N1C(=O)C(=O)/C(=C(\c2ccc(cc2)F)/O)/C1c1ccc(cc1)C(C)C
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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 C26H23FN2O5S MW 494.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H23FN2O5S/c1-13(2)15-5-7-16(8-6-15)20-19(21(30)17-9-11-18(27)12-10-17)22(31)24(32)29(20)26-28-14(3)23(35-26)25(33)34-4/h5-13,20,30H,1-4H3/b21-19+InChIKey
GKEUWXANWCICGO-XUTLUUPISA-NSynonyms
371135-97-6371135976
CC1=C(SC(=N1)N2C(C(=C(C3=CC=C(C=C3)F)O)C(=O)C2=O)C4=CC=C(C=C4)C(C)C)C(=O)OC
COC(=O)c1sc(nc1C)N1C(=O)C(=O)C(=C(c2ccc(cc2)F)O)C1c1ccc(cc1)C(C)C
InChI=1SC26H23FN2O5Sc113(2)155716(8615)2019(21(30)1791118(27)121017)22(31)24(32)29(20)262814(3)23(3526)25(33)344h5132030H14H3b2119+
methyl2((3E)3((4fluorophenyl)(hydroxy)methylidene)45dioxo2(4(propan2yl)phenyl)pyrrolidin1yl)4methyl13thiazole5carboxylate
METHYL2((4E)4((4FLUOROPHENYL)HYDROXYMETHYLIDENE)23DIOXO5(4PROPAN2YLPHENYL)PYRROLIDIN1YL)4METHYL13THIAZOLE5CARBOXYLATE
METHYL2(4((4FLUOROPHENYL)CARBONYL)3HYDROXY5(4(METHYLETHYL)PHENYL)2OXO(3PYRROLINYL))4METHYL13THIAZOLE5CARBOXYLATE
MFCD08730521
ZINC000102701593
ZINC000102701598
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.