methyl 4-[4-oxidanyl-5-oxidanylidene-1-(phenylmethyl)-3-thiophen-2-ylcarbonyl-2H-pyrrol-2-yl]benzoate

Systemtic Name: methyl 4-[4-oxidanyl-5-oxidanylidene-1-(phenylmethyl)-3-thiophen-2-ylcarbonyl-2H-pyrrol-2-yl]benzoate Openeye Name: methyl 4-[1-benzyl-4-hydroxy-5-oxo-3-(thiophene-2-carbonyl)-2H-pyrrol-2-yl]benzoate CAS Name: 4-[4-hydroxy-5-oxo-3-[oxo(thiophen-2-yl)methyl]-1-(phenylmethyl)-2H-pyrrol-2-yl]benzoic acid methyl ester IUPAC Name: methyl 4-[1-benzyl-4-hydroxy-5-oxo-3-(thiophene-2-carbonyl)-2H-pyrrol-2-yl]benzoate Traditional Name: 4-[1-benzyl-4-hydroxy-5-keto-3-(2-thenoyl)-3-pyrrolin-2-yl]benzoic acid methyl ester Formula: C24H19NO5S MolecularWeight: 433.47636

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C2C(=C(C(=O)N2CC3=CC=CC=C3)O)C(=O)C4=CC=CS4

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C2C(=C(C(=O)N2CC3=CC=CC=C3)O)C(=O)C4=CC=CS4

InChI

InChI=1S/C24H19NO5S/c1-30-24(29)17-11-9-16(10-12-17)20-19(21(26)18-8-5-13-31-18)22(27)23(28)25(20)14-15-6-3-2-4-7-15/h2-13,20,27H,14H2,1H3