1-(2-cyanophenyl)sulfonyl-N-[2-(cyclopropylamino)-2-oxidanylidene-ethyl]piperidine-4-carboxamide

Systemtic Name: 1-(2-cyanophenyl)sulfonyl-N-[2-(cyclopropylamino)-2-oxidanylidene-ethyl]piperidine-4-carboxamide Openeye Name: 1-(2-cyanophenyl)sulfonyl-N-[2-(cyclopropylamino)-2-oxo-ethyl]piperidine-4-carboxamide CAS Name: 1-(2-cyanophenyl)sulfonyl-N-[2-(cyclopropylamino)-2-oxoethyl]-4-piperidinecarboxamide IUPAC Name: 1-(2-cyanophenyl)sulfonyl-N-[2-(cyclopropylamino)-2-oxoethyl]piperidine-4-carboxamide Traditional Name: 1-(2-cyanophenyl)sulfonyl-N-[2-(cyclopropylamino)-2-keto-ethyl]isonipecotamide Formula: C18H22N4O4S MolecularWeight: 390.45668

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)CNC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC=C3C#N

Isomeric SMILES

C1CC1NC(=O)CNC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC=C3C#N

InChI

InChI=1S/C18H22N4O4S/c19-11-14-3-1-2-4-16(14)27(25,26)22-9-7-13(8-10-22)18(24)20-12-17(23)21-15-5-6-15/h1-4,13,15H,5-10,12H2,(H,20,24)(H,21,23)