ethyl 4-methyl-2-[4-oxidanyl-5-oxidanylidene-2-(3-phenylmethoxyphenyl)-3-thiophen-2-ylcarbonyl-2H-pyrrol-1-yl]-1,3-thiazole-5-carboxylate

Systemtic Name: ethyl 4-methyl-2-[4-oxidanyl-5-oxidanylidene-2-(3-phenylmethoxyphenyl)-3-thiophen-2-ylcarbonyl-2H-pyrrol-1-yl]-1,3-thiazole-5-carboxylate Openeye Name: ethyl 2-[2-(3-benzyloxyphenyl)-4-hydroxy-5-oxo-3-(thiophene-2-carbonyl)-2H-pyrrol-1-yl]-4-methyl-thiazole-5-carboxylate CAS Name: 2-[4-hydroxy-5-oxo-3-[oxo(thiophen-2-yl)methyl]-2-(3-phenylmethoxyphenyl)-2H-pyrrol-1-yl]-4-methyl-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[4-hydroxy-5-oxo-2-(3-phenylmethoxyphenyl)-3-(thiophene-2-carbonyl)-2H-pyrrol-1-yl]-4-methyl-1,3-thiazole-5-carboxylate Traditional Name: 2-[2-(3-benzoxyphenyl)-4-hydroxy-5-keto-3-(2-thenoyl)-3-pyrrolin-1-yl]-4-methyl-thiazole-5-carboxylic acid ethyl ester Formula: C29H24N2O6S2 MolecularWeight: 560.64066

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(S1)N2C(C(=C(C2=O)O)C(=O)C3=CC=CS3)C4=CC(=CC=C4)OCC5=CC=CC=C5)C

Isomeric SMILES

CCOC(=O)C1=C(N=C(S1)N2C(C(=C(C2=O)O)C(=O)C3=CC=CS3)C4=CC(=CC=C4)OCC5=CC=CC=C5)C

InChI

InChI=1S/C29H24N2O6S2/c1-3-36-28(35)26-17(2)30-29(39-26)31-23(22(25(33)27(31)34)24(32)21-13-8-14-38-21)19-11-7-12-20(15-19)37-16-18-9-5-4-6-10-18/h4-15,23,33H,3,16H2,1-2H3