3-(4-fluorophenyl)-2-[(4-pyridin-2-ylpiperazin-1-yl)methyl]quinazolin-4-one

Systemtic Name: 3-(4-fluorophenyl)-2-[(4-pyridin-2-ylpiperazin-1-yl)methyl]quinazolin-4-one Openeye Name: 3-(4-fluorophenyl)-2-[[4-(2-pyridyl)piperazin-1-yl]methyl]quinazolin-4-one CAS Name: 3-(4-fluorophenyl)-2-[[4-(2-pyridinyl)-1-piperazinyl]methyl]-4-quinazolinone IUPAC Name: 3-(4-fluorophenyl)-2-[(4-pyridin-2-ylpiperazin-1-yl)methyl]quinazolin-4-one Traditional Name: 3-(4-fluorophenyl)-2-[[4-(2-pyridyl)piperazino]methyl]quinazolin-4-one Formula: C24H22FN5O MolecularWeight: 415.462783

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=NC3=CC=CC=C3C(=O)N2C4=CC=C(C=C4)F)C5=CC=CC=N5

Isomeric SMILES

C1CN(CCN1CC2=NC3=CC=CC=C3C(=O)N2C4=CC=C(C=C4)F)C5=CC=CC=N5

InChI

InChI=1S/C24H22FN5O/c25-18-8-10-19(11-9-18)30-23(27-21-6-2-1-5-20(21)24(30)31)17-28-13-15-29(16-14-28)22-7-3-4-12-26-22/h1-12H,13-17H2