(2S)-2-cyano-N-cyclohexyl-2-[3-[(3S)-3-methylpiperidin-1-yl]quinoxalin-2-yl]ethanamide

Systemtic Name: (2S)-2-cyano-N-cyclohexyl-2-[3-[(3S)-3-methylpiperidin-1-yl]quinoxalin-2-yl]ethanamide Openeye Name: (2S)-2-cyano-N-cyclohexyl-2-[3-[(3S)-3-methyl-1-piperidyl]quinoxalin-2-yl]acetamide CAS Name: (2S)-2-cyano-N-cyclohexyl-2-[3-[(3S)-3-methyl-1-piperidinyl]-2-quinoxalinyl]acetamide IUPAC Name: (2S)-2-cyano-N-cyclohexyl-2-[3-[(3S)-3-methylpiperidin-1-yl]quinoxalin-2-yl]acetamide Traditional Name: (2S)-2-cyano-N-cyclohexyl-2-[3-[(3S)-3-methylpiperidino]quinoxalin-2-yl]acetamide Formula: C23H29N5O MolecularWeight: 391.50926

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C2=NC3=CC=CC=C3N=C2C(C#N)C(=O)NC4CCCCC4

Isomeric SMILES

C[C@H]1CCCN(C1)C2=NC3=CC=CC=C3N=C2[C@@H](C#N)C(=O)NC4CCCCC4

InChI

InChI=1S/C23H29N5O/c1-16-8-7-13-28(15-16)22-21(26-19-11-5-6-12-20(19)27-22)18(14-24)23(29)25-17-9-3-2-4-10-17/h5-6,11-12,16-18H,2-4,7-10,13,15H2,1H3,(H,25,29)/t16-,18+/m0/s1