4-[[4-(4-cyanopyridin-2-yl)piperazin-1-yl]methyl]-N-(2-methylphenyl)-3-oxidanyl-naphthalene-2-carboxamide

Systemtic Name: 4-[[4-(4-cyanopyridin-2-yl)piperazin-1-yl]methyl]-N-(2-methylphenyl)-3-oxidanyl-naphthalene-2-carboxamide Openeye Name: 4-[[4-(4-cyano-2-pyridyl)piperazin-1-yl]methyl]-3-hydroxy-N-(o-tolyl)naphthalene-2-carboxamide CAS Name: 4-[[4-(4-cyano-2-pyridinyl)-1-piperazinyl]methyl]-3-hydroxy-N-(2-methylphenyl)-2-naphthalenecarboxamide IUPAC Name: 4-[[4-(4-cyanopyridin-2-yl)piperazin-1-yl]methyl]-3-hydroxy-N-(2-methylphenyl)naphthalene-2-carboxamide Traditional Name: 4-[[4-(4-cyano-2-pyridyl)piperazino]methyl]-3-hydroxy-N-(o-tolyl)-2-naphthamide Formula: C29H27N5O2 MolecularWeight: 477.55698

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)C2=CC3=CC=CC=C3C(=C2O)CN4CCN(CC4)C5=NC=CC(=C5)C#N

Isomeric SMILES

CC1=CC=CC=C1NC(=O)C2=CC3=CC=CC=C3C(=C2O)CN4CCN(CC4)C5=NC=CC(=C5)C#N

InChI

InChI=1S/C29H27N5O2/c1-20-6-2-5-9-26(20)32-29(36)24-17-22-7-3-4-8-23(22)25(28(24)35)19-33-12-14-34(15-13-33)27-16-21(18-30)10-11-31-27/h2-11,16-17,35H,12-15,19H2,1H3,(H,32,36)