2-(1,3-benzoxazol-2-ylsulfanylmethyl)-N-[3-(2-oxidanylidenepyrrolidin-1-yl)phenyl]benzamide

Systemtic Name: 2-(1,3-benzoxazol-2-ylsulfanylmethyl)-N-[3-(2-oxidanylidenepyrrolidin-1-yl)phenyl]benzamide Openeye Name: 2-(1,3-benzoxazol-2-ylsulfanylmethyl)-N-[3-(2-oxopyrrolidin-1-yl)phenyl]benzamide CAS Name: 2-[(1,3-benzoxazol-2-ylthio)methyl]-N-[3-(2-oxo-1-pyrrolidinyl)phenyl]benzamide IUPAC Name: 2-(1,3-benzoxazol-2-ylsulfanylmethyl)-N-[3-(2-oxopyrrolidin-1-yl)phenyl]benzamide Traditional Name: 2-[(1,3-benzoxazol-2-ylthio)methyl]-N-[3-(2-ketopyrrolidino)phenyl]benzamide Formula: C25H21N3O3S MolecularWeight: 443.51754

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)C2=CC(=CC=C2)NC(=O)C3=CC=CC=C3CSC4=NC5=CC=CC=C5O4

Isomeric SMILES

C1CC(=O)N(C1)C2=CC(=CC=C2)NC(=O)C3=CC=CC=C3CSC4=NC5=CC=CC=C5O4

InChI

InChI=1S/C25H21N3O3S/c29-23-13-6-14-28(23)19-9-5-8-18(15-19)26-24(30)20-10-2-1-7-17(20)16-32-25-27-21-11-3-4-12-22(21)31-25/h1-5,7-12,15H,6,13-14,16H2,(H,26,30)