1-[2-nitro-4-(phenylcarbonyl)phenyl]-N-(1,3-thiazol-2-yl)piperidine-4-carboxamide

Systemtic Name: 1-[2-nitro-4-(phenylcarbonyl)phenyl]-N-(1,3-thiazol-2-yl)piperidine-4-carboxamide Openeye Name: 1-(4-benzoyl-2-nitro-phenyl)-N-thiazol-2-yl-piperidine-4-carboxamide CAS Name: 1-(4-benzoyl-2-nitrophenyl)-N-(2-thiazolyl)-4-piperidinecarboxamide IUPAC Name: 1-(4-benzoyl-2-nitrophenyl)-N-(1,3-thiazol-2-yl)piperidine-4-carboxamide Traditional Name: 1-(4-benzoyl-2-nitro-phenyl)-N-thiazol-2-yl-isonipecotamide Formula: C22H20N4O4S MolecularWeight: 436.4836

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=NC=CS2)C3=C(C=C(C=C3)C(=O)C4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCC1C(=O)NC2=NC=CS2)C3=C(C=C(C=C3)C(=O)C4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H20N4O4S/c27-20(15-4-2-1-3-5-15)17-6-7-18(19(14-17)26(29)30)25-11-8-16(9-12-25)21(28)24-22-23-10-13-31-22/h1-7,10,13-14,16H,8-9,11-12H2,(H,23,24,28)