N4-tert-butyl-N6-cyclopentyl-5-nitro-pyrimidine-4,6-diamine

Systemtic Name: N4-tert-butyl-N6-cyclopentyl-5-nitro-pyrimidine-4,6-diamine Openeye Name: N4-tert-butyl-N6-cyclopentyl-5-nitro-pyrimidine-4,6-diamine CAS Name: N4-tert-butyl-N6-cyclopentyl-5-nitropyrimidine-4,6-diamine IUPAC Name: 4-N-tert-butyl-6-N-cyclopentyl-5-nitropyrimidine-4,6-diamine Traditional Name: tert-butyl-[6-(cyclopentylamino)-5-nitro-pyrimidin-4-yl]amine Formula: C13H21N5O2 MolecularWeight: 279.33814

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC1=NC=NC(=C1[N+](=O)[O-])NC2CCCC2

Isomeric SMILES

CC(C)(C)NC1=NC=NC(=C1[N+](=O)[O-])NC2CCCC2

InChI

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