6-fluoranyl-3-[2-[4-[(4-methylphenyl)methyl]-1,4-diazepan-1-yl]-2-oxidanylidene-ethyl]quinazolin-4-one

Systemtic Name: 6-fluoranyl-3-[2-[4-[(4-methylphenyl)methyl]-1,4-diazepan-1-yl]-2-oxidanylidene-ethyl]quinazolin-4-one Openeye Name: 6-fluoro-3-[2-oxo-2-[4-(p-tolylmethyl)-1,4-diazepan-1-yl]ethyl]quinazolin-4-one CAS Name: 6-fluoro-3-[2-[4-[(4-methylphenyl)methyl]-1,4-diazepan-1-yl]-2-oxoethyl]-4-quinazolinone IUPAC Name: 6-fluoro-3-[2-[4-[(4-methylphenyl)methyl]-1,4-diazepan-1-yl]-2-oxoethyl]quinazolin-4-one Traditional Name: 6-fluoro-3-[2-keto-2-[4-(4-methylbenzyl)-1,4-diazepan-1-yl]ethyl]quinazolin-4-one Formula: C23H25FN4O2 MolecularWeight: 408.468603

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2CCCN(CC2)C(=O)CN3C=NC4=C(C3=O)C=C(C=C4)F

Isomeric SMILES

CC1=CC=C(C=C1)CN2CCCN(CC2)C(=O)CN3C=NC4=C(C3=O)C=C(C=C4)F

InChI

InChI=1S/C23H25FN4O2/c1-17-3-5-18(6-4-17)14-26-9-2-10-27(12-11-26)22(29)15-28-16-25-21-8-7-19(24)13-20(21)23(28)30/h3-8,13,16H,2,9-12,14-15H2,1H3