N-[2-[(3-fluorophenyl)amino]-2-oxidanylidene-ethyl]-N-methyl-4-oxidanylidene-3-pentyl-phthalazine-1-carboxamide

Systemtic Name: N-[2-[(3-fluorophenyl)amino]-2-oxidanylidene-ethyl]-N-methyl-4-oxidanylidene-3-pentyl-phthalazine-1-carboxamide Openeye Name: N-[2-(3-fluoroanilino)-2-oxo-ethyl]-N-methyl-4-oxo-3-pentyl-phthalazine-1-carboxamide CAS Name: N-[2-(3-fluoroanilino)-2-oxoethyl]-N-methyl-4-oxo-3-pentyl-1-phthalazinecarboxamide IUPAC Name: N-[2-(3-fluoroanilino)-2-oxoethyl]-N-methyl-4-oxo-3-pentylphthalazine-1-carboxamide Traditional Name: 3-amyl-N-[2-(3-fluoroanilino)-2-keto-ethyl]-4-keto-N-methyl-phthalazine-1-carboxamide Formula: C23H25FN4O3 MolecularWeight: 424.468003

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N(C)CC(=O)NC3=CC(=CC=C3)F

Isomeric SMILES

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N(C)CC(=O)NC3=CC(=CC=C3)F

InChI

InChI=1S/C23H25FN4O3/c1-3-4-7-13-28-22(30)19-12-6-5-11-18(19)21(26-28)23(31)27(2)15-20(29)25-17-10-8-9-16(24)14-17/h5-6,8-12,14H,3-4,7,13,15H2,1-2H3,(H,25,29)