3-(4-fluorophenyl)-2-[[4-(phenylmethyl)piperazin-1-yl]methyl]quinazolin-4-one

Systemtic Name: 3-(4-fluorophenyl)-2-[[4-(phenylmethyl)piperazin-1-yl]methyl]quinazolin-4-one Openeye Name: 2-[(4-benzylpiperazin-1-yl)methyl]-3-(4-fluorophenyl)quinazolin-4-one CAS Name: 3-(4-fluorophenyl)-2-[[4-(phenylmethyl)-1-piperazinyl]methyl]-4-quinazolinone IUPAC Name: 2-[(4-benzylpiperazin-1-yl)methyl]-3-(4-fluorophenyl)quinazolin-4-one Traditional Name: 2-[(4-benzylpiperazino)methyl]-3-(4-fluorophenyl)quinazolin-4-one Formula: C26H25FN4O MolecularWeight: 428.501303

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)CC3=NC4=CC=CC=C4C(=O)N3C5=CC=C(C=C5)F

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)CC3=NC4=CC=CC=C4C(=O)N3C5=CC=C(C=C5)F

InChI

InChI=1S/C26H25FN4O/c27-21-10-12-22(13-11-21)31-25(28-24-9-5-4-8-23(24)26(31)32)19-30-16-14-29(15-17-30)18-20-6-2-1-3-7-20/h1-13H,14-19H2