N-[(4-dimethylaminophenyl)methyl]-3-(2-methylpropyl)-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: N-[(4-dimethylaminophenyl)methyl]-3-(2-methylpropyl)-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: N-[(4-dimethylaminophenyl)methyl]-3-isobutyl-4-oxo-phthalazine-1-carboxamide CAS Name: N-[(4-dimethylaminophenyl)methyl]-3-(2-methylpropyl)-4-oxo-1-phthalazinecarboxamide IUPAC Name: N-[(4-dimethylaminophenyl)methyl]-3-(2-methylpropyl)-4-oxophthalazine-1-carboxamide Traditional Name: N-[4-(dimethylamino)benzyl]-3-isobutyl-4-keto-phthalazine-1-carboxamide Formula: C22H26N4O2 MolecularWeight: 378.46744

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NCC3=CC=C(C=C3)N(C)C

Isomeric SMILES

CC(C)CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NCC3=CC=C(C=C3)N(C)C

InChI

InChI=1S/C22H26N4O2/c1-15(2)14-26-22(28)19-8-6-5-7-18(19)20(24-26)21(27)23-13-16-9-11-17(12-10-16)25(3)4/h5-12,15H,13-14H2,1-4H3,(H,23,27)