4-[2-(2-azanyl-2-ethyl-piperazin-1-yl)pyridin-4-yl]-N-(3-chlorophenyl)pyrimidin-2-amine

Systemtic Name: 4-[2-(2-azanyl-2-ethyl-piperazin-1-yl)pyridin-4-yl]-N-(3-chlorophenyl)pyrimidin-2-amine Openeye Name: 4-[2-(2-amino-2-ethyl-piperazin-1-yl)-4-pyridyl]-N-(3-chlorophenyl)pyrimidin-2-amine CAS Name: 4-[2-(2-amino-2-ethyl-1-piperazinyl)-4-pyridinyl]-N-(3-chlorophenyl)-2-pyrimidinamine IUPAC Name: 4-[2-(2-amino-2-ethylpiperazin-1-yl)pyridin-4-yl]-N-(3-chlorophenyl)pyrimidin-2-amine Traditional Name: [4-[2-(2-amino-2-ethyl-piperazino)-4-pyridyl]pyrimidin-2-yl]-(3-chlorophenyl)amine Formula: C21H24ClN7 MolecularWeight: 409.91516

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(CNCCN1C2=NC=CC(=C2)C3=NC(=NC=C3)NC4=CC(=CC=C4)Cl)N

Isomeric SMILES

CCC1(CNCCN1C2=NC=CC(=C2)C3=NC(=NC=C3)NC4=CC(=CC=C4)Cl)N

InChI

InChI=1S/C21H24ClN7/c1-2-21(23)14-24-10-11-29(21)19-12-15(6-8-25-19)18-7-9-26-20(28-18)27-17-5-3-4-16(22)13-17/h3-9,12-13,24H,2,10-11,14,23H2,1H3,(H,26,27,28)