N6-[2-(cyclohexen-1-yl)ethyl]-N4-(3-methylbutyl)-5-nitro-pyrimidine-4,6-diamine

Systemtic Name: N6-[2-(cyclohexen-1-yl)ethyl]-N4-(3-methylbutyl)-5-nitro-pyrimidine-4,6-diamine Openeye Name: N6-[2-(cyclohexen-1-yl)ethyl]-N4-isopentyl-5-nitro-pyrimidine-4,6-diamine CAS Name: N6-[2-(1-cyclohexenyl)ethyl]-N4-(3-methylbutyl)-5-nitropyrimidine-4,6-diamine IUPAC Name: 6-N-[2-(cyclohexen-1-yl)ethyl]-4-N-(3-methylbutyl)-5-nitropyrimidine-4,6-diamine Traditional Name: 2-(cyclohexen-1-yl)ethyl-[6-(isoamylamino)-5-nitro-pyrimidin-4-yl]amine Formula: C17H27N5O2 MolecularWeight: 333.42858

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC1=NC=NC(=C1[N+](=O)[O-])NCCC2=CCCCC2

Isomeric SMILES

CC(C)CCNC1=NC=NC(=C1[N+](=O)[O-])NCCC2=CCCCC2

InChI

InChI=1S/C17H27N5O2/c1-13(2)8-10-18-16-15(22(23)24)17(21-12-20-16)19-11-9-14-6-4-3-5-7-14/h6,12-13H,3-5,7-11H2,1-2H3,(H2,18,19,20,21)