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

Systemtic Name: 4-oxidanylidene-3-propyl-N-[3-[[3-(trifluoromethyl)phenyl]carbamoyl]phenyl]phthalazine-1-carboxamide Openeye Name: 4-oxo-3-propyl-N-[3-[[3-(trifluoromethyl)phenyl]carbamoyl]phenyl]phthalazine-1-carboxamide CAS Name: 4-oxo-N-[3-[oxo-[3-(trifluoromethyl)anilino]methyl]phenyl]-3-propyl-1-phthalazinecarboxamide IUPAC Name: 4-oxo-3-propyl-N-[3-[[3-(trifluoromethyl)phenyl]carbamoyl]phenyl]phthalazine-1-carboxamide Traditional Name: 4-keto-3-propyl-N-[3-[[3-(trifluoromethyl)phenyl]carbamoyl]phenyl]phthalazine-1-carboxamide Formula: C26H21F3N4O3 MolecularWeight: 494.46515

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=CC=CC(=C3)C(=O)NC4=CC=CC(=C4)C(F)(F)F

Isomeric SMILES

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=CC=CC(=C3)C(=O)NC4=CC=CC(=C4)C(F)(F)F

InChI

InChI=1S/C26H21F3N4O3/c1-2-13-33-25(36)21-12-4-3-11-20(21)22(32-33)24(35)31-18-9-5-7-16(14-18)23(34)30-19-10-6-8-17(15-19)26(27,28)29/h3-12,14-15H,2,13H2,1H3,(H,30,34)(H,31,35)