N-[3-(1,3-benzothiazol-2-yl)propyl]-1-(2-bromophenyl)-5-oxidanylidene-pyrrolidine-3-carboxamide

Systemtic Name: N-[3-(1,3-benzothiazol-2-yl)propyl]-1-(2-bromophenyl)-5-oxidanylidene-pyrrolidine-3-carboxamide Openeye Name: N-[3-(1,3-benzothiazol-2-yl)propyl]-1-(2-bromophenyl)-5-oxo-pyrrolidine-3-carboxamide CAS Name: N-[3-(1,3-benzothiazol-2-yl)propyl]-1-(2-bromophenyl)-5-oxo-3-pyrrolidinecarboxamide IUPAC Name: N-[3-(1,3-benzothiazol-2-yl)propyl]-1-(2-bromophenyl)-5-oxopyrrolidine-3-carboxamide Traditional Name: N-[3-(1,3-benzothiazol-2-yl)propyl]-1-(2-bromophenyl)-5-keto-pyrrolidine-3-carboxamide Formula: C21H20BrN3O2S MolecularWeight: 458.3714

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(C1=O)C2=CC=CC=C2Br)C(=O)NCCCC3=NC4=CC=CC=C4S3

Isomeric SMILES

C1C(CN(C1=O)C2=CC=CC=C2Br)C(=O)NCCCC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C21H20BrN3O2S/c22-15-6-1-3-8-17(15)25-13-14(12-20(25)26)21(27)23-11-5-10-19-24-16-7-2-4-9-18(16)28-19/h1-4,6-9,14H,5,10-13H2,(H,23,27)