3-[1-[2-[(2-ethylphenyl)-phenyl-amino]ethyl]piperidin-4-yl]quinazolin-4-one hydrochloride

Systemtic Name: 3-[1-[2-[(2-ethylphenyl)-phenyl-amino]ethyl]piperidin-4-yl]quinazolin-4-one hydrochloride Openeye Name: 3-[1-[2-(N-(2-ethylphenyl)anilino)ethyl]-4-piperidyl]quinazolin-4-one hydrochloride CAS Name: 3-[1-[2-(N-(2-ethylphenyl)anilino)ethyl]-4-piperidinyl]-4-quinazolinone hydrochloride IUPAC Name: 3-[1-[2-(N-(2-ethylphenyl)anilino)ethyl]piperidin-4-yl]quinazolin-4-one hydrochloride Traditional Name: 3-[1-[2-(N-(2-ethylphenyl)anilino)ethyl]-4-piperidyl]quinazolin-4-one hydrochloride Formula: C29H33ClN4O MolecularWeight: 489.05152

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1N(CCN2CCC(CC2)N3C=NC4=CC=CC=C4C3=O)C5=CC=CC=C5.Cl

Isomeric SMILES

CCC1=CC=CC=C1N(CCN2CCC(CC2)N3C=NC4=CC=CC=C4C3=O)C5=CC=CC=C5.Cl

InChI

InChI=1S/C29H32N4O.ClH/c1-2-23-10-6-9-15-28(23)32(24-11-4-3-5-12-24)21-20-31-18-16-25(17-19-31)33-22-30-27-14-8-7-13-26(27)29(33)34;/h3-15,22,25H,2,16-21H2,1H3;1H