5-[4-methyl-3-(pyridin-2-ylamino)phenyl]-2-(4-pyridin-2-ylpiperazin-1-yl)pyrimidine-4,6-diamine

Systemtic Name: 5-[4-methyl-3-(pyridin-2-ylamino)phenyl]-2-(4-pyridin-2-ylpiperazin-1-yl)pyrimidine-4,6-diamine Openeye Name: 5-[4-methyl-3-(2-pyridylamino)phenyl]-2-[4-(2-pyridyl)piperazin-1-yl]pyrimidine-4,6-diamine CAS Name: 5-[4-methyl-3-(2-pyridinylamino)phenyl]-2-[4-(2-pyridinyl)-1-piperazinyl]pyrimidine-4,6-diamine IUPAC Name: 5-[4-methyl-3-(pyridin-2-ylamino)phenyl]-2-(4-pyridin-2-ylpiperazin-1-yl)pyrimidine-4,6-diamine Traditional Name: [5-[4,6-diamino-2-[4-(2-pyridyl)piperazino]pyrimidin-5-yl]-2-methyl-phenyl]-(2-pyridyl)amine Formula: C25H27N9 MolecularWeight: 453.54218

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=C(N=C(N=C2N)N3CCN(CC3)C4=CC=CC=N4)N)NC5=CC=CC=N5

Isomeric SMILES

CC1=C(C=C(C=C1)C2=C(N=C(N=C2N)N3CCN(CC3)C4=CC=CC=N4)N)NC5=CC=CC=N5

InChI

InChI=1S/C25H27N9/c1-17-8-9-18(16-19(17)30-20-6-2-4-10-28-20)22-23(26)31-25(32-24(22)27)34-14-12-33(13-15-34)21-7-3-5-11-29-21/h2-11,16H,12-15H2,1H3,(H,28,30)(H4,26,27,31,32)