N4-(3-methylbutyl)-N6-(3-morpholin-4-ylpropyl)-5-nitro-pyrimidine-4,6-diamine

Systemtic Name: N4-(3-methylbutyl)-N6-(3-morpholin-4-ylpropyl)-5-nitro-pyrimidine-4,6-diamine Openeye Name: N4-isopentyl-N6-(3-morpholinopropyl)-5-nitro-pyrimidine-4,6-diamine CAS Name: N4-(3-methylbutyl)-N6-[3-(4-morpholinyl)propyl]-5-nitropyrimidine-4,6-diamine IUPAC Name: 4-N-(3-methylbutyl)-6-N-(3-morpholin-4-ylpropyl)-5-nitropyrimidine-4,6-diamine Traditional Name: isoamyl-[6-(3-morpholinopropylamino)-5-nitro-pyrimidin-4-yl]amine Formula: C16H28N6O3 MolecularWeight: 352.43192

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC1=NC=NC(=C1[N+](=O)[O-])NCCCN2CCOCC2

Isomeric SMILES

CC(C)CCNC1=NC=NC(=C1[N+](=O)[O-])NCCCN2CCOCC2

InChI

InChI=1S/C16H28N6O3/c1-13(2)4-6-18-16-14(22(23)24)15(19-12-20-16)17-5-3-7-21-8-10-25-11-9-21/h12-13H,3-11H2,1-2H3,(H2,17,18,19,20)