methyl 3-[2-(2-oxidanylidene-2-pyrrolidin-1-yl-ethanoyl)pyrrol-1-yl]-1-benzothiophene-2-carboxylate

Systemtic Name: methyl 3-[2-(2-oxidanylidene-2-pyrrolidin-1-yl-ethanoyl)pyrrol-1-yl]-1-benzothiophene-2-carboxylate Openeye Name: methyl 3-[2-(2-oxo-2-pyrrolidin-1-yl-acetyl)pyrrol-1-yl]benzothiophene-2-carboxylate CAS Name: 3-[2-[1,2-dioxo-2-(1-pyrrolidinyl)ethyl]-1-pyrrolyl]-1-benzothiophene-2-carboxylic acid methyl ester IUPAC Name: methyl 3-[2-(2-oxo-2-pyrrolidin-1-ylacetyl)pyrrol-1-yl]-1-benzothiophene-2-carboxylate Traditional Name: 3-[2-(2-keto-2-pyrrolidino-acetyl)pyrrol-1-yl]benzothiophene-2-carboxylic acid methyl ester Formula: C20H18N2O4S MolecularWeight: 382.43292

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C2=CC=CC=C2S1)N3C=CC=C3C(=O)C(=O)N4CCCC4

Isomeric SMILES

COC(=O)C1=C(C2=CC=CC=C2S1)N3C=CC=C3C(=O)C(=O)N4CCCC4

InChI

InChI=1S/C20H18N2O4S/c1-26-20(25)18-16(13-7-2-3-9-15(13)27-18)22-12-6-8-14(22)17(23)19(24)21-10-4-5-11-21/h2-3,6-9,12H,4-5,10-11H2,1H3