N-[3-(dimethylamino)propyl]-4-[4-(3-methoxyphenyl)piperazin-1-yl]phthalazine-1-carboxamide

Systemtic Name: N-[3-(dimethylamino)propyl]-4-[4-(3-methoxyphenyl)piperazin-1-yl]phthalazine-1-carboxamide Openeye Name: N-[3-(dimethylamino)propyl]-4-[4-(3-methoxyphenyl)piperazin-1-yl]phthalazine-1-carboxamide CAS Name: N-[3-(dimethylamino)propyl]-4-[4-(3-methoxyphenyl)-1-piperazinyl]-1-phthalazinecarboxamide IUPAC Name: N-[3-(dimethylamino)propyl]-4-[4-(3-methoxyphenyl)piperazin-1-yl]phthalazine-1-carboxamide Traditional Name: N-[3-(dimethylamino)propyl]-4-[4-(3-methoxyphenyl)piperazino]phthalazine-1-carboxamide Formula: C25H32N6O2 MolecularWeight: 448.56058

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCNC(=O)C1=NN=C(C2=CC=CC=C21)N3CCN(CC3)C4=CC(=CC=C4)OC

Isomeric SMILES

CN(C)CCCNC(=O)C1=NN=C(C2=CC=CC=C21)N3CCN(CC3)C4=CC(=CC=C4)OC

InChI

InChI=1S/C25H32N6O2/c1-29(2)13-7-12-26-25(32)23-21-10-4-5-11-22(21)24(28-27-23)31-16-14-30(15-17-31)19-8-6-9-20(18-19)33-3/h4-6,8-11,18H,7,12-17H2,1-3H3,(H,26,32)