ethyl 2-[3-(1-benzofuran-2-ylcarbonyl)-2-(4-butoxyphenyl)-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-butoxyphenyl)-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-butoxyphenyl)-4-hydroxy-5-oxo-2H-pyrrol-1-yl]-4-methyl-thiazole-5-carboxylate CAS Name: 2-[3-[2-benzofuranyl(oxo)methyl]-2-(4-butoxyphenyl)-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-butoxyphenyl)-4-hydroxy-5-oxo-2H-pyrrol-1-yl]-4-methyl-1,3-thiazole-5-carboxylate Traditional Name: 2-[3-(benzofuran-2-carbonyl)-2-(4-butoxyphenyl)-4-hydroxy-5-keto-3-pyrrolin-1-yl]-4-methyl-thiazole-5-carboxylic acid ethyl ester Formula: C30H28N2O7S MolecularWeight: 560.61752

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C2C(=C(C(=O)N2C3=NC(=C(S3)C(=O)OCC)C)O)C(=O)C4=CC5=CC=CC=C5O4

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C2C(=C(C(=O)N2C3=NC(=C(S3)C(=O)OCC)C)O)C(=O)C4=CC5=CC=CC=C5O4

InChI

InChI=1S/C30H28N2O7S/c1-4-6-15-38-20-13-11-18(12-14-20)24-23(25(33)22-16-19-9-7-8-10-21(19)39-22)26(34)28(35)32(24)30-31-17(3)27(40-30)29(36)37-5-2/h7-14,16,24,34H,4-6,15H2,1-3H3