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

Systemtic Name: 3-[4-[4-(4-fluorophenyl)carbonylpiperazin-1-yl]-4-oxidanylidene-butyl]quinazolin-4-one Openeye Name: 3-[4-[4-(4-fluorobenzoyl)piperazin-1-yl]-4-oxo-butyl]quinazolin-4-one CAS Name: 3-[4-[4-[(4-fluorophenyl)-oxomethyl]-1-piperazinyl]-4-oxobutyl]-4-quinazolinone IUPAC Name: 3-[4-[4-(4-fluorobenzoyl)piperazin-1-yl]-4-oxobutyl]quinazolin-4-one Traditional Name: 3-[4-[4-(4-fluorobenzoyl)piperazino]-4-keto-butyl]quinazolin-4-one Formula: C23H23FN4O3 MolecularWeight: 422.452123

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CCCN2C=NC3=CC=CC=C3C2=O)C(=O)C4=CC=C(C=C4)F

Isomeric SMILES

C1CN(CCN1C(=O)CCCN2C=NC3=CC=CC=C3C2=O)C(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C23H23FN4O3/c24-18-9-7-17(8-10-18)22(30)27-14-12-26(13-15-27)21(29)6-3-11-28-16-25-20-5-2-1-4-19(20)23(28)31/h1-2,4-5,7-10,16H,3,6,11-15H2