4-phenyl-3-[1-(pyridin-2-ylmethyl)piperidin-4-yl]-1,4-dihydroquinazolin-2-one hydrochloride

Systemtic Name: 4-phenyl-3-[1-(pyridin-2-ylmethyl)piperidin-4-yl]-1,4-dihydroquinazolin-2-one hydrochloride Openeye Name: 4-phenyl-3-[1-(2-pyridylmethyl)-4-piperidyl]-1,4-dihydroquinazolin-2-one hydrochloride CAS Name: 4-phenyl-3-[1-(2-pyridinylmethyl)-4-piperidinyl]-1,4-dihydroquinazolin-2-one hydrochloride IUPAC Name: 4-phenyl-3-[1-(pyridin-2-ylmethyl)piperidin-4-yl]-1,4-dihydroquinazolin-2-one hydrochloride Traditional Name: 4-phenyl-3-[1-(2-pyridylmethyl)-4-piperidyl]-1,4-dihydroquinazolin-2-one hydrochloride Formula: C25H27ClN4O MolecularWeight: 434.96108

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1N2C(C3=CC=CC=C3NC2=O)C4=CC=CC=C4)CC5=CC=CC=N5.Cl

Isomeric SMILES

C1CN(CCC1N2C(C3=CC=CC=C3NC2=O)C4=CC=CC=C4)CC5=CC=CC=N5.Cl

InChI

InChI=1S/C25H26N4O.ClH/c30-25-27-23-12-5-4-11-22(23)24(19-8-2-1-3-9-19)29(25)21-13-16-28(17-14-21)18-20-10-6-7-15-26-20;/h1-12,15,21,24H,13-14,16-18H2,(H,27,30);1H