6-(3,5-dimethylphenoxy)-N4-(4-methylpiperazin-1-yl)pyrimidine-4,5-diamine

Systemtic Name: 6-(3,5-dimethylphenoxy)-N4-(4-methylpiperazin-1-yl)pyrimidine-4,5-diamine Openeye Name: 6-(3,5-dimethylphenoxy)-N4-(4-methylpiperazin-1-yl)pyrimidine-4,5-diamine CAS Name: 6-(3,5-dimethylphenoxy)-N4-(4-methyl-1-piperazinyl)pyrimidine-4,5-diamine IUPAC Name: 6-(3,5-dimethylphenoxy)-4-N-(4-methylpiperazin-1-yl)pyrimidine-4,5-diamine Traditional Name: [5-amino-6-(3,5-dimethylphenoxy)pyrimidin-4-yl]-(4-methylpiperazino)amine Formula: C17H24N6O MolecularWeight: 328.41206

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OC2=NC=NC(=C2N)NN3CCN(CC3)C)C

Isomeric SMILES

CC1=CC(=CC(=C1)OC2=NC=NC(=C2N)NN3CCN(CC3)C)C

InChI

InChI=1S/C17H24N6O/c1-12-8-13(2)10-14(9-12)24-17-15(18)16(19-11-20-17)21-23-6-4-22(3)5-7-23/h8-11H,4-7,18H2,1-3H3,(H,19,20,21)