N-[1-[3,4-bis(fluoranyl)phenyl]ethyl]-N-methyl-4-oxidanylidene-3-propyl-phthalazine-1-carboxamide

Systemtic Name: N-[1-[3,4-bis(fluoranyl)phenyl]ethyl]-N-methyl-4-oxidanylidene-3-propyl-phthalazine-1-carboxamide Openeye Name: N-[1-(3,4-difluorophenyl)ethyl]-N-methyl-4-oxo-3-propyl-phthalazine-1-carboxamide CAS Name: N-[1-(3,4-difluorophenyl)ethyl]-N-methyl-4-oxo-3-propyl-1-phthalazinecarboxamide IUPAC Name: N-[1-(3,4-difluorophenyl)ethyl]-N-methyl-4-oxo-3-propylphthalazine-1-carboxamide Traditional Name: N-[1-(3,4-difluorophenyl)ethyl]-4-keto-N-methyl-3-propyl-phthalazine-1-carboxamide Formula: C21H21F2N3O2 MolecularWeight: 385.407146

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H21F2N3O2/c1-4-11-26-20(27)16-8-6-5-7-15(16)19(24-26)21(28)25(3)13(2)14-9-10-17(22)18(23)12-14/h5-10,12-13H,4,11H2,1-3H3