1-[2-[(2-nitro-5-propylsulfanyl-phenyl)amino]-2-oxidanylidene-ethyl]-N-phenyl-piperidine-4-carboxamide

Systemtic Name: 1-[2-[(2-nitro-5-propylsulfanyl-phenyl)amino]-2-oxidanylidene-ethyl]-N-phenyl-piperidine-4-carboxamide Openeye Name: 1-[2-(2-nitro-5-propylsulfanyl-anilino)-2-oxo-ethyl]-N-phenyl-piperidine-4-carboxamide CAS Name: 1-[2-[2-nitro-5-(propylthio)anilino]-2-oxoethyl]-N-phenyl-4-piperidinecarboxamide IUPAC Name: 1-[2-(2-nitro-5-propylsulfanylanilino)-2-oxoethyl]-N-phenylpiperidine-4-carboxamide Traditional Name: 1-[2-keto-2-[2-nitro-5-(propylthio)anilino]ethyl]-N-phenyl-isonipecotamide Formula: C23H28N4O4S MolecularWeight: 456.55782

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=CC(=C(C=C1)[N+](=O)[O-])NC(=O)CN2CCC(CC2)C(=O)NC3=CC=CC=C3

Isomeric SMILES

CCCSC1=CC(=C(C=C1)[N+](=O)[O-])NC(=O)CN2CCC(CC2)C(=O)NC3=CC=CC=C3

InChI

InChI=1S/C23H28N4O4S/c1-2-14-32-19-8-9-21(27(30)31)20(15-19)25-22(28)16-26-12-10-17(11-13-26)23(29)24-18-6-4-3-5-7-18/h3-9,15,17H,2,10-14,16H2,1H3,(H,24,29)(H,25,28)