3-[2-oxidanylidene-2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]ethyl]quinazolin-4-one

Systemtic Name: 3-[2-oxidanylidene-2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]ethyl]quinazolin-4-one Openeye Name: 3-[2-oxo-2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]ethyl]quinazolin-4-one CAS Name: 3-[2-oxo-2-[4-[3-(trifluoromethyl)phenyl]-1-piperazinyl]ethyl]-4-quinazolinone IUPAC Name: 3-[2-oxo-2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]ethyl]quinazolin-4-one Traditional Name: 3-[2-keto-2-[4-[3-(trifluoromethyl)phenyl]piperazino]ethyl]quinazolin-4-one Formula: C21H19F3N4O2 MolecularWeight: 416.39637

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC(=C2)C(F)(F)F)C(=O)CN3C=NC4=CC=CC=C4C3=O

Isomeric SMILES

C1CN(CCN1C2=CC=CC(=C2)C(F)(F)F)C(=O)CN3C=NC4=CC=CC=C4C3=O

InChI

InChI=1S/C21H19F3N4O2/c22-21(23,24)15-4-3-5-16(12-15)26-8-10-27(11-9-26)19(29)13-28-14-25-18-7-2-1-6-17(18)20(28)30/h1-7,12,14H,8-11,13H2