ethyl 4-[2,5-bis(oxidanylidene)-3-(4-pyrrol-1-ylphenyl)sulfanyl-pyrrolidin-1-yl]benzoate

Systemtic Name: ethyl 4-[2,5-bis(oxidanylidene)-3-(4-pyrrol-1-ylphenyl)sulfanyl-pyrrolidin-1-yl]benzoate Openeye Name: ethyl 4-[2,5-dioxo-3-(4-pyrrol-1-ylphenyl)sulfanyl-pyrrolidin-1-yl]benzoate CAS Name: 4-[2,5-dioxo-3-[[4-(1-pyrrolyl)phenyl]thio]-1-pyrrolidinyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[2,5-dioxo-3-(4-pyrrol-1-ylphenyl)sulfanylpyrrolidin-1-yl]benzoate Traditional Name: 4-[2,5-diketo-3-[(4-pyrrol-1-ylphenyl)thio]pyrrolidino]benzoic acid ethyl ester Formula: C23H20N2O4S MolecularWeight: 420.4809

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)N2C(=O)CC(C2=O)SC3=CC=C(C=C3)N4C=CC=C4

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)N2C(=O)CC(C2=O)SC3=CC=C(C=C3)N4C=CC=C4

InChI

InChI=1S/C23H20N2O4S/c1-2-29-23(28)16-5-7-18(8-6-16)25-21(26)15-20(22(25)27)30-19-11-9-17(10-12-19)24-13-3-4-14-24/h3-14,20H,2,15H2,1H3