N6-(3,5-dimethylphenyl)-N4-(4-methylpiperazin-1-yl)pyrimidine-4,5,6-triamine

Systemtic Name: N6-(3,5-dimethylphenyl)-N4-(4-methylpiperazin-1-yl)pyrimidine-4,5,6-triamine Openeye Name: N6-(3,5-dimethylphenyl)-N4-(4-methylpiperazin-1-yl)pyrimidine-4,5,6-triamine CAS Name: N6-(3,5-dimethylphenyl)-N4-(4-methyl-1-piperazinyl)pyrimidine-4,5,6-triamine IUPAC Name: 6-N-(3,5-dimethylphenyl)-4-N-(4-methylpiperazin-1-yl)pyrimidine-4,5,6-triamine Traditional Name: [5-amino-6-(3,5-dimethylanilino)pyrimidin-4-yl]-(4-methylpiperazino)amine Formula: C17H25N7 MolecularWeight: 327.4273

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC2=C(C(=NC=N2)NN3CCN(CC3)C)N)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC2=C(C(=NC=N2)NN3CCN(CC3)C)N)C

InChI

InChI=1S/C17H25N7/c1-12-8-13(2)10-14(9-12)21-16-15(18)17(20-11-19-16)22-24-6-4-23(3)5-7-24/h8-11H,4-7,18H2,1-3H3,(H2,19,20,21,22)