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

Systemtic Name: 4-oxidanylidene-3-(phenylmethyl)-N-[[3-(trifluoromethyl)phenyl]methyl]phthalazine-1-carboxamide Openeye Name: 3-benzyl-4-oxo-N-[[3-(trifluoromethyl)phenyl]methyl]phthalazine-1-carboxamide CAS Name: 4-oxo-3-(phenylmethyl)-N-[[3-(trifluoromethyl)phenyl]methyl]-1-phthalazinecarboxamide IUPAC Name: 3-benzyl-4-oxo-N-[[3-(trifluoromethyl)phenyl]methyl]phthalazine-1-carboxamide Traditional Name: 3-benzyl-4-keto-N-[3-(trifluoromethyl)benzyl]phthalazine-1-carboxamide Formula: C24H18F3N3O2 MolecularWeight: 437.41383

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=O)C3=CC=CC=C3C(=N2)C(=O)NCC4=CC(=CC=C4)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=O)C3=CC=CC=C3C(=N2)C(=O)NCC4=CC(=CC=C4)C(F)(F)F

InChI

InChI=1S/C24H18F3N3O2/c25-24(26,27)18-10-6-9-17(13-18)14-28-22(31)21-19-11-4-5-12-20(19)23(32)30(29-21)15-16-7-2-1-3-8-16/h1-13H,14-15H2,(H,28,31)