2-azanyl-N-[1-[[4-(2-methylpropyl)phenyl]methyl]piperidin-3-yl]pyridine-4-carboxamide

Systemtic Name: 2-azanyl-N-[1-[[4-(2-methylpropyl)phenyl]methyl]piperidin-3-yl]pyridine-4-carboxamide Openeye Name: 2-amino-N-[1-[(4-isobutylphenyl)methyl]-3-piperidyl]pyridine-4-carboxamide CAS Name: 2-amino-N-[1-[[4-(2-methylpropyl)phenyl]methyl]-3-piperidinyl]-4-pyridinecarboxamide IUPAC Name: 2-amino-N-[1-[[4-(2-methylpropyl)phenyl]methyl]piperidin-3-yl]pyridine-4-carboxamide Traditional Name: 2-amino-N-[1-(4-isobutylbenzyl)-3-piperidyl]isonicotinamide Formula: C22H30N4O MolecularWeight: 366.4998

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=CC=C(C=C1)CN2CCCC(C2)NC(=O)C3=CC(=NC=C3)N

Isomeric SMILES

CC(C)CC1=CC=C(C=C1)CN2CCCC(C2)NC(=O)C3=CC(=NC=C3)N

InChI

InChI=1S/C22H30N4O/c1-16(2)12-17-5-7-18(8-6-17)14-26-11-3-4-20(15-26)25-22(27)19-9-10-24-21(23)13-19/h5-10,13,16,20H,3-4,11-12,14-15H2,1-2H3,(H2,23,24)(H,25,27)