2-(4-nitrophenyl)sulfanyl-N-[3-(2-oxidanylidene-2-pyrrolidin-1-yl-ethoxy)phenyl]propanamide

Systemtic Name: 2-(4-nitrophenyl)sulfanyl-N-[3-(2-oxidanylidene-2-pyrrolidin-1-yl-ethoxy)phenyl]propanamide Openeye Name: 2-(4-nitrophenyl)sulfanyl-N-[3-(2-oxo-2-pyrrolidin-1-yl-ethoxy)phenyl]propanamide CAS Name: 2-[(4-nitrophenyl)thio]-N-[3-[2-oxo-2-(1-pyrrolidinyl)ethoxy]phenyl]propanamide IUPAC Name: 2-(4-nitrophenyl)sulfanyl-N-[3-(2-oxo-2-pyrrolidin-1-ylethoxy)phenyl]propanamide Traditional Name: N-[3-(2-keto-2-pyrrolidino-ethoxy)phenyl]-2-[(4-nitrophenyl)thio]propionamide Formula: C21H23N3O5S MolecularWeight: 429.48942

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC(=CC=C1)OCC(=O)N2CCCC2)SC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C(=O)NC1=CC(=CC=C1)OCC(=O)N2CCCC2)SC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H23N3O5S/c1-15(30-19-9-7-17(8-10-19)24(27)28)21(26)22-16-5-4-6-18(13-16)29-14-20(25)23-11-2-3-12-23/h4-10,13,15H,2-3,11-12,14H2,1H3,(H,22,26)