N-[4-(3-oxidanylidene-3-pyrrolidin-1-yl-propyl)phenyl]-2-(phenylmethylsulfanyl)benzamide

Systemtic Name: N-[4-(3-oxidanylidene-3-pyrrolidin-1-yl-propyl)phenyl]-2-(phenylmethylsulfanyl)benzamide Openeye Name: 2-benzylsulfanyl-N-[4-(3-oxo-3-pyrrolidin-1-yl-propyl)phenyl]benzamide CAS Name: N-[4-[3-oxo-3-(1-pyrrolidinyl)propyl]phenyl]-2-(phenylmethylthio)benzamide IUPAC Name: 2-benzylsulfanyl-N-[4-(3-oxo-3-pyrrolidin-1-ylpropyl)phenyl]benzamide Traditional Name: 2-(benzylthio)-N-[4-(3-keto-3-pyrrolidino-propyl)phenyl]benzamide Formula: C27H28N2O2S MolecularWeight: 444.58842

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)CCC2=CC=C(C=C2)NC(=O)C3=CC=CC=C3SCC4=CC=CC=C4

Isomeric SMILES

C1CCN(C1)C(=O)CCC2=CC=C(C=C2)NC(=O)C3=CC=CC=C3SCC4=CC=CC=C4

InChI

InChI=1S/C27H28N2O2S/c30-26(29-18-6-7-19-29)17-14-21-12-15-23(16-13-21)28-27(31)24-10-4-5-11-25(24)32-20-22-8-2-1-3-9-22/h1-5,8-13,15-16H,6-7,14,17-20H2,(H,28,31)