3-[1-[2-[(2-propylphenyl)-pyridin-2-yl-amino]ethyl]piperidin-4-yl]quinazolin-4-one

Systemtic Name: 3-[1-[2-[(2-propylphenyl)-pyridin-2-yl-amino]ethyl]piperidin-4-yl]quinazolin-4-one Openeye Name: 3-[1-[2-[2-propyl-N-(2-pyridyl)anilino]ethyl]-4-piperidyl]quinazolin-4-one CAS Name: 3-[1-[2-[2-propyl-N-(2-pyridinyl)anilino]ethyl]-4-piperidinyl]-4-quinazolinone IUPAC Name: 3-[1-[2-(2-propyl-N-pyridin-2-ylanilino)ethyl]piperidin-4-yl]quinazolin-4-one Traditional Name: 3-[1-[2-[2-propyl-N-(2-pyridyl)anilino]ethyl]-4-piperidyl]quinazolin-4-one Formula: C29H33N5O MolecularWeight: 467.60522

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=CC=C1N(CCN2CCC(CC2)N3C=NC4=CC=CC=C4C3=O)C5=CC=CC=N5

Isomeric SMILES

CCCC1=CC=CC=C1N(CCN2CCC(CC2)N3C=NC4=CC=CC=C4C3=O)C5=CC=CC=N5

InChI

InChI=1S/C29H33N5O/c1-2-9-23-10-3-6-13-27(23)33(28-14-7-8-17-30-28)21-20-32-18-15-24(16-19-32)34-22-31-26-12-5-4-11-25(26)29(34)35/h3-8,10-14,17,22,24H,2,9,15-16,18-21H2,1H3