4-[2-[4-(2-azanylethyl)piperazin-1-yl]pyridin-4-yl]-N-(3-chloranyl-4-methyl-phenyl)pyrimidin-2-amine

Systemtic Name: 4-[2-[4-(2-azanylethyl)piperazin-1-yl]pyridin-4-yl]-N-(3-chloranyl-4-methyl-phenyl)pyrimidin-2-amine Openeye Name: 4-[2-[4-(2-aminoethyl)piperazin-1-yl]-4-pyridyl]-N-(3-chloro-4-methyl-phenyl)pyrimidin-2-amine CAS Name: 4-[2-[4-(2-aminoethyl)-1-piperazinyl]-4-pyridinyl]-N-(3-chloro-4-methylphenyl)-2-pyrimidinamine IUPAC Name: 4-[2-[4-(2-aminoethyl)piperazin-1-yl]pyridin-4-yl]-N-(3-chloro-4-methylphenyl)pyrimidin-2-amine Traditional Name: [4-[2-[4-(2-aminoethyl)piperazino]-4-pyridyl]pyrimidin-2-yl]-(3-chloro-4-methyl-phenyl)amine Formula: C22H26ClN7 MolecularWeight: 423.94174

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC2=NC=CC(=N2)C3=CC(=NC=C3)N4CCN(CC4)CCN)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC2=NC=CC(=N2)C3=CC(=NC=C3)N4CCN(CC4)CCN)Cl

InChI

InChI=1S/C22H26ClN7/c1-16-2-3-18(15-19(16)23)27-22-26-8-5-20(28-22)17-4-7-25-21(14-17)30-12-10-29(9-6-24)11-13-30/h2-5,7-8,14-15H,6,9-13,24H2,1H3,(H,26,27,28)