N4-(2-methoxyethyl)-N6-(3-methylbutyl)-5-nitro-pyrimidine-4,6-diamine

Systemtic Name: N4-(2-methoxyethyl)-N6-(3-methylbutyl)-5-nitro-pyrimidine-4,6-diamine Openeye Name: N6-isopentyl-N4-(2-methoxyethyl)-5-nitro-pyrimidine-4,6-diamine CAS Name: N4-(2-methoxyethyl)-N6-(3-methylbutyl)-5-nitropyrimidine-4,6-diamine IUPAC Name: 4-N-(2-methoxyethyl)-6-N-(3-methylbutyl)-5-nitropyrimidine-4,6-diamine Traditional Name: isoamyl-[6-(2-methoxyethylamino)-5-nitro-pyrimidin-4-yl]amine Formula: C12H21N5O3 MolecularWeight: 283.32684

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H21N5O3/c1-9(2)4-5-13-11-10(17(18)19)12(16-8-15-11)14-6-7-20-3/h8-9H,4-7H2,1-3H3,(H2,13,14,15,16)