ethyl 2-[3-(1-benzofuran-2-ylcarbonyl)-2-(3-ethoxy-4-oxidanyl-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-(3-ethoxy-4-oxidanyl-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-(3-ethoxy-4-hydroxy-phenyl)-4-hydroxy-5-oxo-2H-pyrrol-1-yl]-4-methyl-thiazole-5-carboxylate CAS Name: 2-[3-[2-benzofuranyl(oxo)methyl]-2-(3-ethoxy-4-hydroxyphenyl)-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-(3-ethoxy-4-hydroxyphenyl)-4-hydroxy-5-oxo-2H-pyrrol-1-yl]-4-methyl-1,3-thiazole-5-carboxylate Traditional Name: 2-[3-(benzofuran-2-carbonyl)-2-(3-ethoxy-4-hydroxy-phenyl)-4-hydroxy-5-keto-3-pyrrolin-1-yl]-4-methyl-thiazole-5-carboxylic acid ethyl ester Formula: C28H24N2O8S MolecularWeight: 548.56376

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H24N2O8S/c1-4-36-19-13-16(10-11-17(19)31)22-21(23(32)20-12-15-8-6-7-9-18(15)38-20)24(33)26(34)30(22)28-29-14(3)25(39-28)27(35)37-5-2/h6-13,22,31,33H,4-5H2,1-3H3