N-methyl-4-oxidanylidene-3-[[4-[[4-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]methyl]phthalazine-1-carboxamide

Systemtic Name: N-methyl-4-oxidanylidene-3-[[4-[[4-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]methyl]phthalazine-1-carboxamide Openeye Name: N-methyl-4-oxo-3-[[4-[[4-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]methyl]phthalazine-1-carboxamide CAS Name: N-methyl-4-oxo-3-[[4-[[4-(trifluoromethyl)phenyl]methyl]-1-piperazinyl]methyl]-1-phthalazinecarboxamide IUPAC Name: N-methyl-4-oxo-3-[[4-[[4-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]methyl]phthalazine-1-carboxamide Traditional Name: 4-keto-N-methyl-3-[[4-[4-(trifluoromethyl)benzyl]piperazino]methyl]phthalazine-1-carboxamide Formula: C23H24F3N5O2 MolecularWeight: 459.46417

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=NN(C(=O)C2=CC=CC=C21)CN3CCN(CC3)CC4=CC=C(C=C4)C(F)(F)F

Isomeric SMILES

CNC(=O)C1=NN(C(=O)C2=CC=CC=C21)CN3CCN(CC3)CC4=CC=C(C=C4)C(F)(F)F

InChI

InChI=1S/C23H24F3N5O2/c1-27-21(32)20-18-4-2-3-5-19(18)22(33)31(28-20)15-30-12-10-29(11-13-30)14-16-6-8-17(9-7-16)23(24,25)26/h2-9H,10-15H2,1H3,(H,27,32)