ethanoic acid; 6-(4-methylpiperazin-1-yl)-N4-(oxan-4-yl)pyrimidine-2,4-diamine

Systemtic Name: ethanoic acid; 6-(4-methylpiperazin-1-yl)-N4-(oxan-4-yl)pyrimidine-2,4-diamine Openeye Name: acetic acid; 6-(4-methylpiperazin-1-yl)-N4-tetrahydropyran-4-yl-pyrimidine-2,4-diamine CAS Name: acetic acid; 6-(4-methyl-1-piperazinyl)-N4-(4-oxanyl)pyrimidine-2,4-diamine IUPAC Name: acetic acid; 6-(4-methylpiperazin-1-yl)-4-N-(oxan-4-yl)pyrimidine-2,4-diamine Traditional Name: acetic acid; [2-amino-6-(4-methylpiperazino)pyrimidin-4-yl]-tetrahydropyran-4-yl-amine Formula: C16H28N6O3 MolecularWeight: 352.43192

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)O.CN1CCN(CC1)C2=CC(=NC(=N2)N)NC3CCOCC3

Isomeric SMILES

CC(=O)O.CN1CCN(CC1)C2=CC(=NC(=N2)N)NC3CCOCC3

InChI

InChI=1S/C14H24N6O.C2H4O2/c1-19-4-6-20(7-5-19)13-10-12(17-14(15)18-13)16-11-2-8-21-9-3-11;1-2(3)4/h10-11H,2-9H2,1H3,(H3,15,16,17,18);1H3,(H,3,4)