N-[1-(2,5-dimethylphenyl)ethyl]-4-oxidanylidene-3-propyl-phthalazine-1-carboxamide

Systemtic Name: N-[1-(2,5-dimethylphenyl)ethyl]-4-oxidanylidene-3-propyl-phthalazine-1-carboxamide Openeye Name: N-[1-(2,5-dimethylphenyl)ethyl]-4-oxo-3-propyl-phthalazine-1-carboxamide CAS Name: N-[1-(2,5-dimethylphenyl)ethyl]-4-oxo-3-propyl-1-phthalazinecarboxamide IUPAC Name: N-[1-(2,5-dimethylphenyl)ethyl]-4-oxo-3-propylphthalazine-1-carboxamide Traditional Name: N-[1-(2,5-dimethylphenyl)ethyl]-4-keto-3-propyl-phthalazine-1-carboxamide Formula: C22H25N3O2 MolecularWeight: 363.4528

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC(C)C3=C(C=CC(=C3)C)C

Isomeric SMILES

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC(C)C3=C(C=CC(=C3)C)C

InChI

InChI=1S/C22H25N3O2/c1-5-12-25-22(27)18-9-7-6-8-17(18)20(24-25)21(26)23-16(4)19-13-14(2)10-11-15(19)3/h6-11,13,16H,5,12H2,1-4H3,(H,23,26)