5-[[4-(3-chlorophenyl)piperazin-1-yl]methyl]-2-methyl-pyrimidin-4-amine dihydrochloride

Systemtic Name: 5-[[4-(3-chlorophenyl)piperazin-1-yl]methyl]-2-methyl-pyrimidin-4-amine dihydrochloride Openeye Name: 5-[[4-(3-chlorophenyl)piperazin-1-yl]methyl]-2-methyl-pyrimidin-4-amine dihydrochloride CAS Name: 5-[[4-(3-chlorophenyl)-1-piperazinyl]methyl]-2-methyl-4-pyrimidinamine dihydrochloride IUPAC Name: 5-[[4-(3-chlorophenyl)piperazin-1-yl]methyl]-2-methylpyrimidin-4-amine dihydrochloride Traditional Name: [5-[[4-(3-chlorophenyl)piperazino]methyl]-2-methyl-pyrimidin-4-yl]amine dihydrochloride Formula: C16H22Cl3N5 MolecularWeight: 390.73838

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C(=N1)N)CN2CCN(CC2)C3=CC(=CC=C3)Cl.Cl.Cl

Isomeric SMILES

CC1=NC=C(C(=N1)N)CN2CCN(CC2)C3=CC(=CC=C3)Cl.Cl.Cl

InChI

InChI=1S/C16H20ClN5.2ClH/c1-12-19-10-13(16(18)20-12)11-21-5-7-22(8-6-21)15-4-2-3-14(17)9-15;;/h2-4,9-10H,5-8,11H2,1H3,(H2,18,19,20);2*1H