N6-cyclohexyl-5-nitro-N4-propan-2-yl-pyrimidine-4,6-diamine

Systemtic Name: N6-cyclohexyl-5-nitro-N4-propan-2-yl-pyrimidine-4,6-diamine Openeye Name: N6-cyclohexyl-N4-isopropyl-5-nitro-pyrimidine-4,6-diamine CAS Name: N6-cyclohexyl-5-nitro-N4-propan-2-ylpyrimidine-4,6-diamine IUPAC Name: 6-N-cyclohexyl-5-nitro-4-N-propan-2-ylpyrimidine-4,6-diamine Traditional Name: cyclohexyl-[6-(isopropylamino)-5-nitro-pyrimidin-4-yl]amine Formula: C13H21N5O2 MolecularWeight: 279.33814

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC1=NC=NC(=C1[N+](=O)[O-])NC2CCCCC2

Isomeric SMILES

CC(C)NC1=NC=NC(=C1[N+](=O)[O-])NC2CCCCC2

InChI

InChI=1S/C13H21N5O2/c1-9(2)16-12-11(18(19)20)13(15-8-14-12)17-10-6-4-3-5-7-10/h8-10H,3-7H2,1-2H3,(H2,14,15,16,17)