N-(6-nitro-1,3-benzothiazol-2-yl)-5-oxidanylidene-1-phenyl-pyrrolidine-3-carboxamide

Systemtic Name: N-(6-nitro-1,3-benzothiazol-2-yl)-5-oxidanylidene-1-phenyl-pyrrolidine-3-carboxamide Openeye Name: N-(6-nitro-1,3-benzothiazol-2-yl)-5-oxo-1-phenyl-pyrrolidine-3-carboxamide CAS Name: N-(6-nitro-1,3-benzothiazol-2-yl)-5-oxo-1-phenyl-3-pyrrolidinecarboxamide IUPAC Name: N-(6-nitro-1,3-benzothiazol-2-yl)-5-oxo-1-phenylpyrrolidine-3-carboxamide Traditional Name: 5-keto-N-(6-nitro-1,3-benzothiazol-2-yl)-1-phenyl-pyrrolidine-3-carboxamide Formula: C18H14N4O4S MolecularWeight: 382.39316

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(C1=O)C2=CC=CC=C2)C(=O)NC3=NC4=C(S3)C=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1C(CN(C1=O)C2=CC=CC=C2)C(=O)NC3=NC4=C(S3)C=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C18H14N4O4S/c23-16-8-11(10-21(16)12-4-2-1-3-5-12)17(24)20-18-19-14-7-6-13(22(25)26)9-15(14)27-18/h1-7,9,11H,8,10H2,(H,19,20,24)