N6-(5-methyl-1,2-oxazol-3-yl)-N4-(4-methylpiperazin-1-yl)pyrimidine-4,5,6-triamine

Systemtic Name: N6-(5-methyl-1,2-oxazol-3-yl)-N4-(4-methylpiperazin-1-yl)pyrimidine-4,5,6-triamine Openeye Name: N6-(5-methylisoxazol-3-yl)-N4-(4-methylpiperazin-1-yl)pyrimidine-4,5,6-triamine CAS Name: N6-(5-methyl-3-isoxazolyl)-N4-(4-methyl-1-piperazinyl)pyrimidine-4,5,6-triamine IUPAC Name: 6-N-(5-methyl-1,2-oxazol-3-yl)-4-N-(4-methylpiperazin-1-yl)pyrimidine-4,5,6-triamine Traditional Name: [5-amino-6-[(5-methylisoxazol-3-yl)amino]pyrimidin-4-yl]-(4-methylpiperazino)amine Formula: C13H20N8O MolecularWeight: 304.3509

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)NC2=C(C(=NC=N2)NN3CCN(CC3)C)N

Isomeric SMILES

CC1=CC(=NO1)NC2=C(C(=NC=N2)NN3CCN(CC3)C)N

InChI

InChI=1S/C13H20N8O/c1-9-7-10(19-22-9)17-12-11(14)13(16-8-15-12)18-21-5-3-20(2)4-6-21/h7-8H,3-6,14H2,1-2H3,(H2,15,16,17,18,19)