N4-(1-methoxypropan-2-yl)-N6-(3-methylbutyl)-5-nitro-pyrimidine-4,6-diamine

Systemtic Name: N4-(1-methoxypropan-2-yl)-N6-(3-methylbutyl)-5-nitro-pyrimidine-4,6-diamine Openeye Name: N6-isopentyl-N4-(2-methoxy-1-methyl-ethyl)-5-nitro-pyrimidine-4,6-diamine CAS Name: N4-(1-methoxypropan-2-yl)-N6-(3-methylbutyl)-5-nitropyrimidine-4,6-diamine IUPAC Name: 4-N-(1-methoxypropan-2-yl)-6-N-(3-methylbutyl)-5-nitropyrimidine-4,6-diamine Traditional Name: isoamyl-[6-[(2-methoxy-1-methyl-ethyl)amino]-5-nitro-pyrimidin-4-yl]amine Formula: C13H23N5O3 MolecularWeight: 297.35342

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H23N5O3/c1-9(2)5-6-14-12-11(18(19)20)13(16-8-15-12)17-10(3)7-21-4/h8-10H,5-7H2,1-4H3,(H2,14,15,16,17)