3-[1-[2-[phenyl(pyrimidin-5-yl)amino]ethyl]piperidin-4-yl]quinazolin-4-one

Systemtic Name: 3-[1-[2-[phenyl(pyrimidin-5-yl)amino]ethyl]piperidin-4-yl]quinazolin-4-one Openeye Name: 3-[1-[2-(N-pyrimidin-5-ylanilino)ethyl]-4-piperidyl]quinazolin-4-one CAS Name: 3-[1-[2-[N-(5-pyrimidinyl)anilino]ethyl]-4-piperidinyl]-4-quinazolinone IUPAC Name: 3-[1-[2-(N-pyrimidin-5-ylanilino)ethyl]piperidin-4-yl]quinazolin-4-one Traditional Name: 3-[1-[2-[N-(5-pyrimidyl)anilino]ethyl]-4-piperidyl]quinazolin-4-one Formula: C25H26N6O MolecularWeight: 426.51354

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1N2C=NC3=CC=CC=C3C2=O)CCN(C4=CC=CC=C4)C5=CN=CN=C5

Isomeric SMILES

C1CN(CCC1N2C=NC3=CC=CC=C3C2=O)CCN(C4=CC=CC=C4)C5=CN=CN=C5

InChI

InChI=1S/C25H26N6O/c32-25-23-8-4-5-9-24(23)28-19-31(25)21-10-12-29(13-11-21)14-15-30(20-6-2-1-3-7-20)22-16-26-18-27-17-22/h1-9,16-19,21H,10-15H2