ethyl 4-[(2S)-4-oxidanyl-5-oxidanylidene-2-pyridin-3-yl-3-thiophen-2-ylcarbonyl-2H-pyrrol-1-yl]benzoate

Systemtic Name: ethyl 4-[(2S)-4-oxidanyl-5-oxidanylidene-2-pyridin-3-yl-3-thiophen-2-ylcarbonyl-2H-pyrrol-1-yl]benzoate Openeye Name: ethyl 4-[(2S)-4-hydroxy-5-oxo-2-(3-pyridyl)-3-(thiophene-2-carbonyl)-2H-pyrrol-1-yl]benzoate CAS Name: 4-[(2S)-4-hydroxy-5-oxo-3-[oxo(thiophen-2-yl)methyl]-2-(3-pyridinyl)-2H-pyrrol-1-yl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(2S)-4-hydroxy-5-oxo-2-pyridin-3-yl-3-(thiophene-2-carbonyl)-2H-pyrrol-1-yl]benzoate Traditional Name: 4-[(5S)-3-hydroxy-2-keto-5-(3-pyridyl)-4-(2-thenoyl)-3-pyrrolin-1-yl]benzoic acid ethyl ester Formula: C23H18N2O5S MolecularWeight: 434.46442

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)N2C(C(=C(C2=O)O)C(=O)C3=CC=CS3)C4=CN=CC=C4

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)N2[C@H](C(=C(C2=O)O)C(=O)C3=CC=CS3)C4=CN=CC=C4

InChI

InChI=1S/C23H18N2O5S/c1-2-30-23(29)14-7-9-16(10-8-14)25-19(15-5-3-11-24-13-15)18(21(27)22(25)28)20(26)17-6-4-12-31-17/h3-13,19,27H,2H2,1H3/t19-/m0/s1