N-(6-nitro-1,3-benzothiazol-2-yl)-1-(5-oxidanylidene-1-phenyl-pyrrolidin-3-yl)carbonyl-piperidine-4-carboxamide

Systemtic Name: N-(6-nitro-1,3-benzothiazol-2-yl)-1-(5-oxidanylidene-1-phenyl-pyrrolidin-3-yl)carbonyl-piperidine-4-carboxamide Openeye Name: N-(6-nitro-1,3-benzothiazol-2-yl)-1-(5-oxo-1-phenyl-pyrrolidine-3-carbonyl)piperidine-4-carboxamide CAS Name: N-(6-nitro-1,3-benzothiazol-2-yl)-1-[oxo-(5-oxo-1-phenyl-3-pyrrolidinyl)methyl]-4-piperidinecarboxamide IUPAC Name: N-(6-nitro-1,3-benzothiazol-2-yl)-1-(5-oxo-1-phenylpyrrolidine-3-carbonyl)piperidine-4-carboxamide Traditional Name: 1-(5-keto-1-phenyl-pyrrolidine-3-carbonyl)-N-(6-nitro-1,3-benzothiazol-2-yl)isonipecotamide Formula: C24H23N5O5S MolecularWeight: 493.53492

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-])C(=O)C4CC(=O)N(C4)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCC1C(=O)NC2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-])C(=O)C4CC(=O)N(C4)C5=CC=CC=C5

InChI

InChI=1S/C24H23N5O5S/c30-21-12-16(14-28(21)17-4-2-1-3-5-17)23(32)27-10-8-15(9-11-27)22(31)26-24-25-19-7-6-18(29(33)34)13-20(19)35-24/h1-7,13,15-16H,8-12,14H2,(H,25,26,31)