3-(2-oxidanylidenepyrrolidin-1-yl)-N-[4-(pyridin-3-ylmethylsulfanyl)phenyl]benzamide

Systemtic Name: 3-(2-oxidanylidenepyrrolidin-1-yl)-N-[4-(pyridin-3-ylmethylsulfanyl)phenyl]benzamide Openeye Name: 3-(2-oxopyrrolidin-1-yl)-N-[4-(3-pyridylmethylsulfanyl)phenyl]benzamide CAS Name: 3-(2-oxo-1-pyrrolidinyl)-N-[4-(3-pyridinylmethylthio)phenyl]benzamide IUPAC Name: 3-(2-oxopyrrolidin-1-yl)-N-[4-(pyridin-3-ylmethylsulfanyl)phenyl]benzamide Traditional Name: 3-(2-ketopyrrolidino)-N-[4-(3-pyridylmethylthio)phenyl]benzamide Formula: C23H21N3O2S MolecularWeight: 403.49674

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)C2=CC=CC(=C2)C(=O)NC3=CC=C(C=C3)SCC4=CN=CC=C4

Isomeric SMILES

C1CC(=O)N(C1)C2=CC=CC(=C2)C(=O)NC3=CC=C(C=C3)SCC4=CN=CC=C4

InChI

InChI=1S/C23H21N3O2S/c27-22-7-3-13-26(22)20-6-1-5-18(14-20)23(28)25-19-8-10-21(11-9-19)29-16-17-4-2-12-24-15-17/h1-2,4-6,8-12,14-15H,3,7,13,16H2,(H,25,28)