2-(1,3-benzothiazol-2-ylmethylsulfanyl)-N-[3-(2-oxidanylidenepyrrolidin-1-yl)phenyl]ethanamide

Systemtic Name: 2-(1,3-benzothiazol-2-ylmethylsulfanyl)-N-[3-(2-oxidanylidenepyrrolidin-1-yl)phenyl]ethanamide Openeye Name: 2-(1,3-benzothiazol-2-ylmethylsulfanyl)-N-[3-(2-oxopyrrolidin-1-yl)phenyl]acetamide CAS Name: 2-(1,3-benzothiazol-2-ylmethylthio)-N-[3-(2-oxo-1-pyrrolidinyl)phenyl]acetamide IUPAC Name: 2-(1,3-benzothiazol-2-ylmethylsulfanyl)-N-[3-(2-oxopyrrolidin-1-yl)phenyl]acetamide Traditional Name: 2-(1,3-benzothiazol-2-ylmethylthio)-N-[3-(2-ketopyrrolidino)phenyl]acetamide Formula: C20H19N3O2S2 MolecularWeight: 397.51376

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)C2=CC(=CC=C2)NC(=O)CSCC3=NC4=CC=CC=C4S3

Isomeric SMILES

C1CC(=O)N(C1)C2=CC(=CC=C2)NC(=O)CSCC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C20H19N3O2S2/c24-18(12-26-13-19-22-16-7-1-2-8-17(16)27-19)21-14-5-3-6-15(11-14)23-10-4-9-20(23)25/h1-3,5-8,11H,4,9-10,12-13H2,(H,21,24)