6-bromanyl-3-[3-[4-(4-fluorophenyl)carbonylpiperazin-1-yl]-3-oxidanylidene-propyl]quinazolin-4-one

Systemtic Name: 6-bromanyl-3-[3-[4-(4-fluorophenyl)carbonylpiperazin-1-yl]-3-oxidanylidene-propyl]quinazolin-4-one Openeye Name: 6-bromo-3-[3-[4-(4-fluorobenzoyl)piperazin-1-yl]-3-oxo-propyl]quinazolin-4-one CAS Name: 6-bromo-3-[3-[4-[(4-fluorophenyl)-oxomethyl]-1-piperazinyl]-3-oxopropyl]-4-quinazolinone IUPAC Name: 6-bromo-3-[3-[4-(4-fluorobenzoyl)piperazin-1-yl]-3-oxopropyl]quinazolin-4-one Traditional Name: 6-bromo-3-[3-[4-(4-fluorobenzoyl)piperazino]-3-keto-propyl]quinazolin-4-one Formula: C22H20BrFN4O3 MolecularWeight: 487.321603

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CCN2C=NC3=C(C2=O)C=C(C=C3)Br)C(=O)C4=CC=C(C=C4)F

Isomeric SMILES

C1CN(CCN1C(=O)CCN2C=NC3=C(C2=O)C=C(C=C3)Br)C(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C22H20BrFN4O3/c23-16-3-6-19-18(13-16)22(31)28(14-25-19)8-7-20(29)26-9-11-27(12-10-26)21(30)15-1-4-17(24)5-2-15/h1-6,13-14H,7-12H2