5-(4-chlorophenyl)-N4-(2-methoxyphenyl)-2-(4-methylpiperazin-1-yl)pyrimidine-4,6-diamine

Systemtic Name: 5-(4-chlorophenyl)-N4-(2-methoxyphenyl)-2-(4-methylpiperazin-1-yl)pyrimidine-4,6-diamine Openeye Name: 5-(4-chlorophenyl)-N4-(2-methoxyphenyl)-2-(4-methylpiperazin-1-yl)pyrimidine-4,6-diamine CAS Name: 5-(4-chlorophenyl)-N4-(2-methoxyphenyl)-2-(4-methyl-1-piperazinyl)pyrimidine-4,6-diamine IUPAC Name: 5-(4-chlorophenyl)-4-N-(2-methoxyphenyl)-2-(4-methylpiperazin-1-yl)pyrimidine-4,6-diamine Traditional Name: [6-amino-5-(4-chlorophenyl)-2-(4-methylpiperazino)pyrimidin-4-yl]-(2-methoxyphenyl)amine Formula: C22H25ClN6O MolecularWeight: 424.9265

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=NC(=C(C(=N2)NC3=CC=CC=C3OC)C4=CC=C(C=C4)Cl)N

Isomeric SMILES

CN1CCN(CC1)C2=NC(=C(C(=N2)NC3=CC=CC=C3OC)C4=CC=C(C=C4)Cl)N

InChI

InChI=1S/C22H25ClN6O/c1-28-11-13-29(14-12-28)22-26-20(24)19(15-7-9-16(23)10-8-15)21(27-22)25-17-5-3-4-6-18(17)30-2/h3-10H,11-14H2,1-2H3,(H3,24,25,26,27)