1-(4-cyanophenyl)sulfonyl-N-[3-(2-oxidanylideneazepan-1-yl)propyl]piperidine-4-carboxamide

Systemtic Name: 1-(4-cyanophenyl)sulfonyl-N-[3-(2-oxidanylideneazepan-1-yl)propyl]piperidine-4-carboxamide Openeye Name: 1-(4-cyanophenyl)sulfonyl-N-[3-(2-oxoazepan-1-yl)propyl]piperidine-4-carboxamide CAS Name: 1-(4-cyanophenyl)sulfonyl-N-[3-(2-oxo-1-azepanyl)propyl]-4-piperidinecarboxamide IUPAC Name: 1-(4-cyanophenyl)sulfonyl-N-[3-(2-oxoazepan-1-yl)propyl]piperidine-4-carboxamide Traditional Name: 1-(4-cyanophenyl)sulfonyl-N-[3-(2-ketoazepan-1-yl)propyl]isonipecotamide Formula: C22H30N4O4S MolecularWeight: 446.563

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=O)N(CC1)CCCNC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C#N

Isomeric SMILES

C1CCC(=O)N(CC1)CCCNC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C22H30N4O4S/c23-17-18-6-8-20(9-7-18)31(29,30)26-15-10-19(11-16-26)22(28)24-12-4-14-25-13-3-1-2-5-21(25)27/h6-9,19H,1-5,10-16H2,(H,24,28)