N-(3-nitrophenyl)-2-[1-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)indol-3-yl]sulfanyl-ethanamide

Systemtic Name: N-(3-nitrophenyl)-2-[1-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)indol-3-yl]sulfanyl-ethanamide Openeye Name: N-(3-nitrophenyl)-2-[1-(2-oxo-2-pyrrolidin-1-yl-ethyl)indol-3-yl]sulfanyl-acetamide CAS Name: N-(3-nitrophenyl)-2-[[1-[2-oxo-2-(1-pyrrolidinyl)ethyl]-3-indolyl]thio]acetamide IUPAC Name: N-(3-nitrophenyl)-2-[1-(2-oxo-2-pyrrolidin-1-ylethyl)indol-3-yl]sulfanylacetamide Traditional Name: 2-[[1-(2-keto-2-pyrrolidino-ethyl)indol-3-yl]thio]-N-(3-nitrophenyl)acetamide Formula: C22H22N4O4S MolecularWeight: 438.49948

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)CN2C=C(C3=CC=CC=C32)SCC(=O)NC4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)C(=O)CN2C=C(C3=CC=CC=C32)SCC(=O)NC4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H22N4O4S/c27-21(23-16-6-5-7-17(12-16)26(29)30)15-31-20-13-25(19-9-2-1-8-18(19)20)14-22(28)24-10-3-4-11-24/h1-2,5-9,12-13H,3-4,10-11,14-15H2,(H,23,27)