8-methyl-3-[3-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]-3-oxidanylidene-propyl]quinazolin-4-one

Systemtic Name: 8-methyl-3-[3-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]-3-oxidanylidene-propyl]quinazolin-4-one Openeye Name: 8-methyl-3-[3-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]-3-oxo-propyl]quinazolin-4-one CAS Name: 8-methyl-3-[3-[4-[2-nitro-4-(trifluoromethyl)phenyl]-1-piperazinyl]-3-oxopropyl]-4-quinazolinone IUPAC Name: 8-methyl-3-[3-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]-3-oxopropyl]quinazolin-4-one Traditional Name: 3-[3-keto-3-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazino]propyl]-8-methyl-quinazolin-4-one Formula: C23H22F3N5O4 MolecularWeight: 489.44709

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1N=CN(C2=O)CCC(=O)N3CCN(CC3)C4=C(C=C(C=C4)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=CC2=C1N=CN(C2=O)CCC(=O)N3CCN(CC3)C4=C(C=C(C=C4)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C23H22F3N5O4/c1-15-3-2-4-17-21(15)27-14-30(22(17)33)8-7-20(32)29-11-9-28(10-12-29)18-6-5-16(23(24,25)26)13-19(18)31(34)35/h2-6,13-14H,7-12H2,1H3