6-bromanyl-3-[2-[4-[(2-fluorophenyl)methyl]piperazin-1-yl]-2-oxidanylidene-ethyl]quinazolin-4-one

Systemtic Name: 6-bromanyl-3-[2-[4-[(2-fluorophenyl)methyl]piperazin-1-yl]-2-oxidanylidene-ethyl]quinazolin-4-one Openeye Name: 6-bromo-3-[2-[4-[(2-fluorophenyl)methyl]piperazin-1-yl]-2-oxo-ethyl]quinazolin-4-one CAS Name: 6-bromo-3-[2-[4-[(2-fluorophenyl)methyl]-1-piperazinyl]-2-oxoethyl]-4-quinazolinone IUPAC Name: 6-bromo-3-[2-[4-[(2-fluorophenyl)methyl]piperazin-1-yl]-2-oxoethyl]quinazolin-4-one Traditional Name: 6-bromo-3-[2-[4-(2-fluorobenzyl)piperazino]-2-keto-ethyl]quinazolin-4-one Formula: C21H20BrFN4O2 MolecularWeight: 459.311503

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2F)C(=O)CN3C=NC4=C(C3=O)C=C(C=C4)Br

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2F)C(=O)CN3C=NC4=C(C3=O)C=C(C=C4)Br

InChI

InChI=1S/C21H20BrFN4O2/c22-16-5-6-19-17(11-16)21(29)27(14-24-19)13-20(28)26-9-7-25(8-10-26)12-15-3-1-2-4-18(15)23/h1-6,11,14H,7-10,12-13H2