N2-(3-methylbutyl)-6-morpholin-4-yl-5-nitro-pyrimidine-2,4-diamine

Systemtic Name: N2-(3-methylbutyl)-6-morpholin-4-yl-5-nitro-pyrimidine-2,4-diamine Openeye Name: N2-isopentyl-6-morpholino-5-nitro-pyrimidine-2,4-diamine CAS Name: N2-(3-methylbutyl)-6-(4-morpholinyl)-5-nitropyrimidine-2,4-diamine IUPAC Name: 2-N-(3-methylbutyl)-6-morpholin-4-yl-5-nitropyrimidine-2,4-diamine Traditional Name: (4-amino-6-morpholino-5-nitro-pyrimidin-2-yl)-isoamyl-amine Formula: C13H22N6O3 MolecularWeight: 310.35218

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC1=NC(=C(C(=N1)N)[N+](=O)[O-])N2CCOCC2

Isomeric SMILES

CC(C)CCNC1=NC(=C(C(=N1)N)[N+](=O)[O-])N2CCOCC2

InChI

InChI=1S/C13H22N6O3/c1-9(2)3-4-15-13-16-11(14)10(19(20)21)12(17-13)18-5-7-22-8-6-18/h9H,3-8H2,1-2H3,(H3,14,15,16,17)