ethyl 2-[3-(1-benzofuran-2-ylcarbonyl)-2-(4-ethoxy-3-methoxy-phenyl)-4-oxidanyl-5-oxidanylidene-2H-pyrrol-1-yl]-4-methyl-1,3-thiazole-5-carboxylate

Systemtic Name: ethyl 2-[3-(1-benzofuran-2-ylcarbonyl)-2-(4-ethoxy-3-methoxy-phenyl)-4-oxidanyl-5-oxidanylidene-2H-pyrrol-1-yl]-4-methyl-1,3-thiazole-5-carboxylate Openeye Name: ethyl 2-[3-(benzofuran-2-carbonyl)-2-(4-ethoxy-3-methoxy-phenyl)-4-hydroxy-5-oxo-2H-pyrrol-1-yl]-4-methyl-thiazole-5-carboxylate CAS Name: 2-[3-[2-benzofuranyl(oxo)methyl]-2-(4-ethoxy-3-methoxyphenyl)-4-hydroxy-5-oxo-2H-pyrrol-1-yl]-4-methyl-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[3-(1-benzofuran-2-carbonyl)-2-(4-ethoxy-3-methoxyphenyl)-4-hydroxy-5-oxo-2H-pyrrol-1-yl]-4-methyl-1,3-thiazole-5-carboxylate Traditional Name: 2-[3-(benzofuran-2-carbonyl)-2-(4-ethoxy-3-methoxy-phenyl)-4-hydroxy-5-keto-3-pyrrolin-1-yl]-4-methyl-thiazole-5-carboxylic acid ethyl ester Formula: C29H26N2O8S MolecularWeight: 562.59034

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C2C(=C(C(=O)N2C3=NC(=C(S3)C(=O)OCC)C)O)C(=O)C4=CC5=CC=CC=C5O4)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C2C(=C(C(=O)N2C3=NC(=C(S3)C(=O)OCC)C)O)C(=O)C4=CC5=CC=CC=C5O4)OC

InChI

InChI=1S/C29H26N2O8S/c1-5-37-19-12-11-17(14-20(19)36-4)23-22(24(32)21-13-16-9-7-8-10-18(16)39-21)25(33)27(34)31(23)29-30-15(3)26(40-29)28(35)38-6-2/h7-14,23,33H,5-6H2,1-4H3