4-[1-[(3-cyanophenyl)methyl]piperidin-4-yl]-N-propan-2-yl-piperazine-1-carboxamide

Systemtic Name: 4-[1-[(3-cyanophenyl)methyl]piperidin-4-yl]-N-propan-2-yl-piperazine-1-carboxamide Openeye Name: 4-[1-[(3-cyanophenyl)methyl]-4-piperidyl]-N-isopropyl-piperazine-1-carboxamide CAS Name: 4-[1-[(3-cyanophenyl)methyl]-4-piperidinyl]-N-propan-2-yl-1-piperazinecarboxamide IUPAC Name: 4-[1-[(3-cyanophenyl)methyl]piperidin-4-yl]-N-propan-2-ylpiperazine-1-carboxamide Traditional Name: 4-[1-(3-cyanobenzyl)-4-piperidyl]-N-isopropyl-piperazine-1-carboxamide Formula: C21H31N5O MolecularWeight: 369.50374

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)N1CCN(CC1)C2CCN(CC2)CC3=CC=CC(=C3)C#N

Isomeric SMILES

CC(C)NC(=O)N1CCN(CC1)C2CCN(CC2)CC3=CC=CC(=C3)C#N

InChI

InChI=1S/C21H31N5O/c1-17(2)23-21(27)26-12-10-25(11-13-26)20-6-8-24(9-7-20)16-19-5-3-4-18(14-19)15-22/h3-5,14,17,20H,6-13,16H2,1-2H3,(H,23,27)