N-[(1S,2R)-2-(cyanomethylcarbamoyl)cyclohexyl]-4-(1-ethylpiperidin-4-yl)benzamide

Systemtic Name: N-[(1S,2R)-2-(cyanomethylcarbamoyl)cyclohexyl]-4-(1-ethylpiperidin-4-yl)benzamide Openeye Name: N-[(1S,2R)-2-(cyanomethylcarbamoyl)cyclohexyl]-4-(1-ethyl-4-piperidyl)benzamide CAS Name: N-[(1S,2R)-2-[(cyanomethylamino)-oxomethyl]cyclohexyl]-4-(1-ethyl-4-piperidinyl)benzamide IUPAC Name: N-[(1S,2R)-2-(cyanomethylcarbamoyl)cyclohexyl]-4-(1-ethylpiperidin-4-yl)benzamide Traditional Name: N-[(1S,2R)-2-(cyanomethylcarbamoyl)cyclohexyl]-4-(1-ethyl-4-piperidyl)benzamide Formula: C23H32N4O2 MolecularWeight: 396.52578

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCC(CC1)C2=CC=C(C=C2)C(=O)NC3CCCCC3C(=O)NCC#N

Isomeric SMILES

CCN1CCC(CC1)C2=CC=C(C=C2)C(=O)N[C@H]3CCCC[C@H]3C(=O)NCC#N

InChI

InChI=1S/C23H32N4O2/c1-2-27-15-11-18(12-16-27)17-7-9-19(10-8-17)22(28)26-21-6-4-3-5-20(21)23(29)25-14-13-24/h7-10,18,20-21H,2-6,11-12,14-16H2,1H3,(H,25,29)(H,26,28)/t20-,21+/m1/s1