6-[4-(3-chlorophenyl)piperazin-1-yl]-N4-pyridin-4-yl-pyrimidine-4,5-diamine

Systemtic Name: 6-[4-(3-chlorophenyl)piperazin-1-yl]-N4-pyridin-4-yl-pyrimidine-4,5-diamine Openeye Name: 6-[4-(3-chlorophenyl)piperazin-1-yl]-N4-(4-pyridyl)pyrimidine-4,5-diamine CAS Name: 6-[4-(3-chlorophenyl)-1-piperazinyl]-N4-pyridin-4-ylpyrimidine-4,5-diamine IUPAC Name: 6-[4-(3-chlorophenyl)piperazin-1-yl]-4-N-pyridin-4-ylpyrimidine-4,5-diamine Traditional Name: [5-amino-6-[4-(3-chlorophenyl)piperazino]pyrimidin-4-yl]-(4-pyridyl)amine Formula: C19H20ClN7 MolecularWeight: 381.862

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC(=CC=C2)Cl)C3=C(C(=NC=N3)NC4=CC=NC=C4)N

Isomeric SMILES

C1CN(CCN1C2=CC(=CC=C2)Cl)C3=C(C(=NC=N3)NC4=CC=NC=C4)N

InChI

InChI=1S/C19H20ClN7/c20-14-2-1-3-16(12-14)26-8-10-27(11-9-26)19-17(21)18(23-13-24-19)25-15-4-6-22-7-5-15/h1-7,12-13H,8-11,21H2,(H,22,23,24,25)