N4-(4-methylpiperazin-1-yl)-N6-(3-morpholin-4-ylpropyl)-5-nitro-pyrimidine-4,6-diamine

Systemtic Name: N4-(4-methylpiperazin-1-yl)-N6-(3-morpholin-4-ylpropyl)-5-nitro-pyrimidine-4,6-diamine Openeye Name: N4-(4-methylpiperazin-1-yl)-N6-(3-morpholinopropyl)-5-nitro-pyrimidine-4,6-diamine CAS Name: N4-(4-methyl-1-piperazinyl)-N6-[3-(4-morpholinyl)propyl]-5-nitropyrimidine-4,6-diamine IUPAC Name: 4-N-(4-methylpiperazin-1-yl)-6-N-(3-morpholin-4-ylpropyl)-5-nitropyrimidine-4,6-diamine Traditional Name: (4-methylpiperazino)-[6-(3-morpholinopropylamino)-5-nitro-pyrimidin-4-yl]amine Formula: C16H28N8O3 MolecularWeight: 380.44532

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)NC2=NC=NC(=C2[N+](=O)[O-])NCCCN3CCOCC3

Isomeric SMILES

CN1CCN(CC1)NC2=NC=NC(=C2[N+](=O)[O-])NCCCN3CCOCC3

InChI

InChI=1S/C16H28N8O3/c1-21-5-7-23(8-6-21)20-16-14(24(25)26)15(18-13-19-16)17-3-2-4-22-9-11-27-12-10-22/h13H,2-12H2,1H3,(H2,17,18,19,20)