N-(butylcarbamoyl)-2-[4-(2,5-dimethylphenyl)-1-oxidanylidene-phthalazin-2-yl]ethanamide

Systemtic Name: N-(butylcarbamoyl)-2-[4-(2,5-dimethylphenyl)-1-oxidanylidene-phthalazin-2-yl]ethanamide Openeye Name: N-(butylcarbamoyl)-2-[4-(2,5-dimethylphenyl)-1-oxo-phthalazin-2-yl]acetamide CAS Name: N-[butylamino(oxo)methyl]-2-[4-(2,5-dimethylphenyl)-1-oxo-2-phthalazinyl]acetamide IUPAC Name: N-(butylcarbamoyl)-2-[4-(2,5-dimethylphenyl)-1-oxophthalazin-2-yl]acetamide Traditional Name: N-(butylcarbamoyl)-2-[4-(2,5-dimethylphenyl)-1-keto-phthalazin-2-yl]acetamide Formula: C23H26N4O3 MolecularWeight: 406.47754

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)NC(=O)CN1C(=O)C2=CC=CC=C2C(=N1)C3=C(C=CC(=C3)C)C

Isomeric SMILES

CCCCNC(=O)NC(=O)CN1C(=O)C2=CC=CC=C2C(=N1)C3=C(C=CC(=C3)C)C

InChI

InChI=1S/C23H26N4O3/c1-4-5-12-24-23(30)25-20(28)14-27-22(29)18-9-7-6-8-17(18)21(26-27)19-13-15(2)10-11-16(19)3/h6-11,13H,4-5,12,14H2,1-3H3,(H2,24,25,28,30)