N-[4-(cyanomethyl)piperidin-4-yl]-3-cyclohexyl-2-[(3-oxidanylideneisoindol-1-yl)amino]propanamide

Systemtic Name: N-[4-(cyanomethyl)piperidin-4-yl]-3-cyclohexyl-2-[(3-oxidanylideneisoindol-1-yl)amino]propanamide Openeye Name: N-[4-(cyanomethyl)-4-piperidyl]-3-cyclohexyl-2-[(3-oxoisoindol-1-yl)amino]propanamide CAS Name: N-[4-(cyanomethyl)-4-piperidinyl]-3-cyclohexyl-2-[(3-oxo-1-isoindolyl)amino]propanamide IUPAC Name: N-[4-(cyanomethyl)piperidin-4-yl]-3-cyclohexyl-2-[(3-oxoisoindol-1-yl)amino]propanamide Traditional Name: N-[4-(cyanomethyl)-4-piperidyl]-3-cyclohexyl-2-[(3-ketoisoindol-1-yl)amino]propionamide Formula: C24H31N5O2 MolecularWeight: 421.53524

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CC(C(=O)NC2(CCNCC2)CC#N)NC3=NC(=O)C4=CC=CC=C43

Isomeric SMILES

C1CCC(CC1)CC(C(=O)NC2(CCNCC2)CC#N)NC3=NC(=O)C4=CC=CC=C43

InChI

InChI=1S/C24H31N5O2/c25-13-10-24(11-14-26-15-12-24)29-23(31)20(16-17-6-2-1-3-7-17)27-21-18-8-4-5-9-19(18)22(30)28-21/h4-5,8-9,17,20,26H,1-3,6-7,10-12,14-16H2,(H,29,31)(H,27,28,30)