ethyl 2-[3-(1-benzofuran-2-ylcarbonyl)-2-(4-dimethylaminophenyl)-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-dimethylaminophenyl)-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-dimethylaminophenyl)-4-hydroxy-5-oxo-2H-pyrrol-1-yl]-4-methyl-thiazole-5-carboxylate CAS Name: 2-[3-[2-benzofuranyl(oxo)methyl]-2-(4-dimethylaminophenyl)-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-dimethylaminophenyl)-4-hydroxy-5-oxo-2H-pyrrol-1-yl]-4-methyl-1,3-thiazole-5-carboxylate Traditional Name: 2-[3-(benzofuran-2-carbonyl)-2-(4-dimethylaminophenyl)-4-hydroxy-5-keto-3-pyrrolin-1-yl]-4-methyl-thiazole-5-carboxylic acid ethyl ester Formula: C28H25N3O6S MolecularWeight: 531.5796

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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=CC4=CC=CC=C4O3)C5=CC=C(C=C5)N(C)C)C

Isomeric SMILES

CCOC(=O)C1=C(N=C(S1)N2C(C(=C(C2=O)O)C(=O)C3=CC4=CC=CC=C4O3)C5=CC=C(C=C5)N(C)C)C

InChI

InChI=1S/C28H25N3O6S/c1-5-36-27(35)25-15(2)29-28(38-25)31-22(16-10-12-18(13-11-16)30(3)4)21(24(33)26(31)34)23(32)20-14-17-8-6-7-9-19(17)37-20/h6-14,22,33H,5H2,1-4H3