2-(1,3-benzothiazol-2-yl)-N-(4-nitrophenyl)pyrrolidine-1-carboxamide

Systemtic Name: 2-(1,3-benzothiazol-2-yl)-N-(4-nitrophenyl)pyrrolidine-1-carboxamide Openeye Name: 2-(1,3-benzothiazol-2-yl)-N-(4-nitrophenyl)pyrrolidine-1-carboxamide CAS Name: 2-(1,3-benzothiazol-2-yl)-N-(4-nitrophenyl)-1-pyrrolidinecarboxamide IUPAC Name: 2-(1,3-benzothiazol-2-yl)-N-(4-nitrophenyl)pyrrolidine-1-carboxamide Traditional Name: 2-(1,3-benzothiazol-2-yl)-N-(4-nitrophenyl)pyrrolidine-1-carboxamide Formula: C18H16N4O3S MolecularWeight: 368.40964

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)NC2=CC=C(C=C2)[N+](=O)[O-])C3=NC4=CC=CC=C4S3

Isomeric SMILES

C1CC(N(C1)C(=O)NC2=CC=C(C=C2)[N+](=O)[O-])C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C18H16N4O3S/c23-18(19-12-7-9-13(10-8-12)22(24)25)21-11-3-5-15(21)17-20-14-4-1-2-6-16(14)26-17/h1-2,4,6-10,15H,3,5,11H2,(H,19,23)