3-[(2S)-1-[4-(4-fluorophenyl)piperazin-1-yl]-1-oxidanylidene-propan-2-yl]quinazolin-4-one

Systemtic Name: 3-[(2S)-1-[4-(4-fluorophenyl)piperazin-1-yl]-1-oxidanylidene-propan-2-yl]quinazolin-4-one Openeye Name: 3-[(1S)-2-[4-(4-fluorophenyl)piperazin-1-yl]-1-methyl-2-oxo-ethyl]quinazolin-4-one CAS Name: 3-[(2S)-1-[4-(4-fluorophenyl)-1-piperazinyl]-1-oxopropan-2-yl]-4-quinazolinone IUPAC Name: 3-[(2S)-1-[4-(4-fluorophenyl)piperazin-1-yl]-1-oxopropan-2-yl]quinazolin-4-one Traditional Name: 3-[(1S)-2-[4-(4-fluorophenyl)piperazino]-2-keto-1-methyl-ethyl]quinazolin-4-one Formula: C21H21FN4O2 MolecularWeight: 380.415443

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCN(CC1)C2=CC=C(C=C2)F)N3C=NC4=CC=CC=C4C3=O

Isomeric SMILES

C[C@@H](C(=O)N1CCN(CC1)C2=CC=C(C=C2)F)N3C=NC4=CC=CC=C4C3=O

InChI

InChI=1S/C21H21FN4O2/c1-15(26-14-23-19-5-3-2-4-18(19)21(26)28)20(27)25-12-10-24(11-13-25)17-8-6-16(22)7-9-17/h2-9,14-15H,10-13H2,1H3/t15-/m0/s1