Vitas-M small molecule compound
ethyl 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
STL043976
SMILES CCOC(=O)c1sc(nc1C)N1C(c2ccc(cc2)C(C)C)/C(=C(/c2ccc(cc2)F)\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 C27H25FN2O5S MW 508.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H25FN2O5S/c1-5-35-26(34)24-15(4)29-27(36-24)30-21(17-8-6-16(7-9-17)14(2)3)20(23(32)25(30)33)22(31)18-10-12-19(28)13-11-18/h6-14,21,31H,5H2,1-4H3/b22-20+InChIKey
FCXNQQHEQAQHCC-LSDHQDQOSA-NSynonyms
CCOC(=O)C1=C(N=C(S1)N2C(C(=C(C3=CC=C(C=C3)F)O)C(=O)C2=O)C4=CC=C(C=C4)C(C)C)C
CCOC(=O)c1sc(nc1C)N1C(c2ccc(cc2)C(C)C)C(=C(c2ccc(cc2)F)O)C(=O)C1=O
ethyl2((3E)3((4fluorophenyl)(hydroxy)methylidene)45dioxo2(4(propan2yl)phenyl)pyrrolidin1yl)4methyl13thiazole5carboxylate
ETHYL2((4E)4((4FLUOROPHENYL)HYDROXYMETHYLIDENE)23DIOXO5(4PROPAN2YLPHENYL)PYRROLIDIN1YL)4METHYL13THIAZOLE5CARBOXYLATE
InChI=1SC27H25FN2O5Sc153526(34)2415(4)2927(3624)3021(178616(7917)14(2)3)20(23(32)25(30)33)22(31)18101219(28)131118h6142131H5H214H3b2220+
MFCD03797979
ZINC000102874345
ZINC000102874348
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Check stock on Vitas-MAvailable files
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