3-[3-azanyl-4-(4-pyrimidin-2-ylpiperazin-1-yl)phenyl]-4-methyl-4,5-dihydro-1H-pyridazin-6-one

Systemtic Name: 3-[3-azanyl-4-(4-pyrimidin-2-ylpiperazin-1-yl)phenyl]-4-methyl-4,5-dihydro-1H-pyridazin-6-one Openeye Name: 3-[3-amino-4-(4-pyrimidin-2-ylpiperazin-1-yl)phenyl]-4-methyl-4,5-dihydro-1H-pyridazin-6-one CAS Name: 3-[3-amino-4-[4-(2-pyrimidinyl)-1-piperazinyl]phenyl]-4-methyl-4,5-dihydro-1H-pyridazin-6-one IUPAC Name: 3-[3-amino-4-(4-pyrimidin-2-ylpiperazin-1-yl)phenyl]-4-methyl-4,5-dihydro-1H-pyridazin-6-one Traditional Name: 3-[3-amino-4-[4-(2-pyrimidyl)piperazino]phenyl]-4-methyl-4,5-dihydro-1H-pyridazin-6-one Formula: C19H23N7O MolecularWeight: 365.43222

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=O)NN=C1C2=CC(=C(C=C2)N3CCN(CC3)C4=NC=CC=N4)N

Isomeric SMILES

CC1CC(=O)NN=C1C2=CC(=C(C=C2)N3CCN(CC3)C4=NC=CC=N4)N

InChI

InChI=1S/C19H23N7O/c1-13-11-17(27)23-24-18(13)14-3-4-16(15(20)12-14)25-7-9-26(10-8-25)19-21-5-2-6-22-19/h2-6,12-13H,7-11,20H2,1H3,(H,23,27)