N-[[1-(dimethylamino)cyclohexyl]methyl]-4-oxidanylidene-3-(phenylmethyl)phthalazine-1-carboxamide

Systemtic Name: N-[[1-(dimethylamino)cyclohexyl]methyl]-4-oxidanylidene-3-(phenylmethyl)phthalazine-1-carboxamide Openeye Name: 3-benzyl-N-[[1-(dimethylamino)cyclohexyl]methyl]-4-oxo-phthalazine-1-carboxamide CAS Name: N-[[1-(dimethylamino)cyclohexyl]methyl]-4-oxo-3-(phenylmethyl)-1-phthalazinecarboxamide IUPAC Name: 3-benzyl-N-[[1-(dimethylamino)cyclohexyl]methyl]-4-oxophthalazine-1-carboxamide Traditional Name: 3-benzyl-N-[[1-(dimethylamino)cyclohexyl]methyl]-4-keto-phthalazine-1-carboxamide Formula: C25H30N4O2 MolecularWeight: 418.5313

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1(CCCCC1)CNC(=O)C2=NN(C(=O)C3=CC=CC=C32)CC4=CC=CC=C4

Isomeric SMILES

CN(C)C1(CCCCC1)CNC(=O)C2=NN(C(=O)C3=CC=CC=C32)CC4=CC=CC=C4

InChI

InChI=1S/C25H30N4O2/c1-28(2)25(15-9-4-10-16-25)18-26-23(30)22-20-13-7-8-14-21(20)24(31)29(27-22)17-19-11-5-3-6-12-19/h3,5-8,11-14H,4,9-10,15-18H2,1-2H3,(H,26,30)