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

Systemtic Name: 6-[4-(4-methoxyphenyl)piperazin-1-yl]-N4-pyridin-4-yl-pyrimidine-4,5-diamine Openeye Name: 6-[4-(4-methoxyphenyl)piperazin-1-yl]-N4-(4-pyridyl)pyrimidine-4,5-diamine CAS Name: 6-[4-(4-methoxyphenyl)-1-piperazinyl]-N4-pyridin-4-ylpyrimidine-4,5-diamine IUPAC Name: 6-[4-(4-methoxyphenyl)piperazin-1-yl]-4-N-pyridin-4-ylpyrimidine-4,5-diamine Traditional Name: [5-amino-6-[4-(4-methoxyphenyl)piperazino]pyrimidin-4-yl]-(4-pyridyl)amine Formula: C20H23N7O MolecularWeight: 377.44292

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2CCN(CC2)C3=C(C(=NC=N3)NC4=CC=NC=C4)N

Isomeric SMILES

COC1=CC=C(C=C1)N2CCN(CC2)C3=C(C(=NC=N3)NC4=CC=NC=C4)N

InChI

InChI=1S/C20H23N7O/c1-28-17-4-2-16(3-5-17)26-10-12-27(13-11-26)20-18(21)19(23-14-24-20)25-15-6-8-22-9-7-15/h2-9,14H,10-13,21H2,1H3,(H,22,23,24,25)