N-[4-(dimethylamino)-2-(trifluoromethyl)phenyl]-4-oxidanylidene-3-propyl-phthalazine-1-carboxamide

Systemtic Name: N-[4-(dimethylamino)-2-(trifluoromethyl)phenyl]-4-oxidanylidene-3-propyl-phthalazine-1-carboxamide Openeye Name: N-[4-(dimethylamino)-2-(trifluoromethyl)phenyl]-4-oxo-3-propyl-phthalazine-1-carboxamide CAS Name: N-[4-(dimethylamino)-2-(trifluoromethyl)phenyl]-4-oxo-3-propyl-1-phthalazinecarboxamide IUPAC Name: N-[4-(dimethylamino)-2-(trifluoromethyl)phenyl]-4-oxo-3-propylphthalazine-1-carboxamide Traditional Name: N-[4-(dimethylamino)-2-(trifluoromethyl)phenyl]-4-keto-3-propyl-phthalazine-1-carboxamide Formula: C21H21F3N4O2 MolecularWeight: 418.41225

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=C(C=C(C=C3)N(C)C)C(F)(F)F

Isomeric SMILES

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=C(C=C(C=C3)N(C)C)C(F)(F)F

InChI

InChI=1S/C21H21F3N4O2/c1-4-11-28-20(30)15-8-6-5-7-14(15)18(26-28)19(29)25-17-10-9-13(27(2)3)12-16(17)21(22,23)24/h5-10,12H,4,11H2,1-3H3,(H,25,29)