1-[3-[(1S)-1-cyano-2-(cyclohexylamino)-2-oxidanylidene-ethyl]quinoxalin-2-yl]piperidine-4-carboxamide

Systemtic Name: 1-[3-[(1S)-1-cyano-2-(cyclohexylamino)-2-oxidanylidene-ethyl]quinoxalin-2-yl]piperidine-4-carboxamide Openeye Name: 1-[3-[(1S)-1-cyano-2-(cyclohexylamino)-2-oxo-ethyl]quinoxalin-2-yl]piperidine-4-carboxamide CAS Name: 1-[3-[(1S)-1-cyano-2-(cyclohexylamino)-2-oxoethyl]-2-quinoxalinyl]-4-piperidinecarboxamide IUPAC Name: 1-[3-[(1S)-1-cyano-2-(cyclohexylamino)-2-oxoethyl]quinoxalin-2-yl]piperidine-4-carboxamide Traditional Name: 1-[3-[(1S)-1-cyano-2-(cyclohexylamino)-2-keto-ethyl]quinoxalin-2-yl]isonipecotamide Formula: C23H28N6O2 MolecularWeight: 420.50742

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)C(C#N)C2=NC3=CC=CC=C3N=C2N4CCC(CC4)C(=O)N

Isomeric SMILES

C1CCC(CC1)NC(=O)[C@H](C#N)C2=NC3=CC=CC=C3N=C2N4CCC(CC4)C(=O)N

InChI

InChI=1S/C23H28N6O2/c24-14-17(23(31)26-16-6-2-1-3-7-16)20-22(28-19-9-5-4-8-18(19)27-20)29-12-10-15(11-13-29)21(25)30/h4-5,8-9,15-17H,1-3,6-7,10-13H2,(H2,25,30)(H,26,31)/t17-/m1/s1