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

Systemtic Name: 3-[3-[4-(4-fluorophenyl)carbonylpiperazin-1-yl]-3-oxidanylidene-propyl]quinazolin-4-one Openeye Name: 3-[3-[4-(4-fluorobenzoyl)piperazin-1-yl]-3-oxo-propyl]quinazolin-4-one CAS Name: 3-[3-[4-[(4-fluorophenyl)-oxomethyl]-1-piperazinyl]-3-oxopropyl]-4-quinazolinone IUPAC Name: 3-[3-[4-(4-fluorobenzoyl)piperazin-1-yl]-3-oxopropyl]quinazolin-4-one Traditional Name: 3-[3-[4-(4-fluorobenzoyl)piperazino]-3-keto-propyl]quinazolin-4-one Formula: C22H21FN4O3 MolecularWeight: 408.425543

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CCN2C=NC3=CC=CC=C3C2=O)C(=O)C4=CC=C(C=C4)F

Isomeric SMILES

C1CN(CCN1C(=O)CCN2C=NC3=CC=CC=C3C2=O)C(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C22H21FN4O3/c23-17-7-5-16(6-8-17)21(29)26-13-11-25(12-14-26)20(28)9-10-27-15-24-19-4-2-1-3-18(19)22(27)30/h1-8,15H,9-14H2