3-[3-[phenyl(pyridin-3-yl)amino]propyl]-2-piperidin-4-yl-quinazolin-4-one

Systemtic Name: 3-[3-[phenyl(pyridin-3-yl)amino]propyl]-2-piperidin-4-yl-quinazolin-4-one Openeye Name: 2-(4-piperidyl)-3-[3-[N-(3-pyridyl)anilino]propyl]quinazolin-4-one CAS Name: 2-(4-piperidinyl)-3-[3-[N-(3-pyridinyl)anilino]propyl]-4-quinazolinone IUPAC Name: 2-piperidin-4-yl-3-[3-(N-pyridin-3-ylanilino)propyl]quinazolin-4-one Traditional Name: 2-(4-piperidyl)-3-[3-[N-(3-pyridyl)anilino]propyl]quinazolin-4-one Formula: C27H29N5O MolecularWeight: 439.55206

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1C2=NC3=CC=CC=C3C(=O)N2CCCN(C4=CC=CC=C4)C5=CN=CC=C5

Isomeric SMILES

C1CNCCC1C2=NC3=CC=CC=C3C(=O)N2CCCN(C4=CC=CC=C4)C5=CN=CC=C5

InChI

InChI=1S/C27H29N5O/c33-27-24-11-4-5-12-25(24)30-26(21-13-16-28-17-14-21)32(27)19-7-18-31(22-8-2-1-3-9-22)23-10-6-15-29-20-23/h1-6,8-12,15,20-21,28H,7,13-14,16-19H2