4-(1,3-benzothiazol-2-ylsulfanylmethyl)-N-[3-[(2-oxidanylidenepyrrolidin-1-yl)methyl]phenyl]benzamide

Systemtic Name: 4-(1,3-benzothiazol-2-ylsulfanylmethyl)-N-[3-[(2-oxidanylidenepyrrolidin-1-yl)methyl]phenyl]benzamide Openeye Name: 4-(1,3-benzothiazol-2-ylsulfanylmethyl)-N-[3-[(2-oxopyrrolidin-1-yl)methyl]phenyl]benzamide CAS Name: 4-[(1,3-benzothiazol-2-ylthio)methyl]-N-[3-[(2-oxo-1-pyrrolidinyl)methyl]phenyl]benzamide IUPAC Name: 4-(1,3-benzothiazol-2-ylsulfanylmethyl)-N-[3-[(2-oxopyrrolidin-1-yl)methyl]phenyl]benzamide Traditional Name: 4-[(1,3-benzothiazol-2-ylthio)methyl]-N-[3-[(2-ketopyrrolidino)methyl]phenyl]benzamide Formula: C26H23N3O2S2 MolecularWeight: 473.60972

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)CC2=CC(=CC=C2)NC(=O)C3=CC=C(C=C3)CSC4=NC5=CC=CC=C5S4

Isomeric SMILES

C1CC(=O)N(C1)CC2=CC(=CC=C2)NC(=O)C3=CC=C(C=C3)CSC4=NC5=CC=CC=C5S4

InChI

InChI=1S/C26H23N3O2S2/c30-24-9-4-14-29(24)16-19-5-3-6-21(15-19)27-25(31)20-12-10-18(11-13-20)17-32-26-28-22-7-1-2-8-23(22)33-26/h1-3,5-8,10-13,15H,4,9,14,16-17H2,(H,27,31)