4-(1,3-benzothiazol-2-yl)-N-[3-chloranyl-4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]butanamide

Systemtic Name: 4-(1,3-benzothiazol-2-yl)-N-[3-chloranyl-4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]butanamide Openeye Name: 4-(1,3-benzothiazol-2-yl)-N-[3-chloro-4-(2-oxopyrrolidin-1-yl)phenyl]butanamide CAS Name: 4-(1,3-benzothiazol-2-yl)-N-[3-chloro-4-(2-oxo-1-pyrrolidinyl)phenyl]butanamide IUPAC Name: 4-(1,3-benzothiazol-2-yl)-N-[3-chloro-4-(2-oxopyrrolidin-1-yl)phenyl]butanamide Traditional Name: 4-(1,3-benzothiazol-2-yl)-N-[3-chloro-4-(2-ketopyrrolidino)phenyl]butyramide Formula: C21H20ClN3O2S MolecularWeight: 413.9204

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)C2=C(C=C(C=C2)NC(=O)CCCC3=NC4=CC=CC=C4S3)Cl

Isomeric SMILES

C1CC(=O)N(C1)C2=C(C=C(C=C2)NC(=O)CCCC3=NC4=CC=CC=C4S3)Cl

InChI

InChI=1S/C21H20ClN3O2S/c22-15-13-14(10-11-17(15)25-12-4-9-21(25)27)23-19(26)7-3-8-20-24-16-5-1-2-6-18(16)28-20/h1-2,5-6,10-11,13H,3-4,7-9,12H2,(H,23,26)