N6-butan-2-yl-N4-tert-butyl-5-nitro-pyrimidine-4,6-diamine

Systemtic Name: N6-butan-2-yl-N4-tert-butyl-5-nitro-pyrimidine-4,6-diamine Openeye Name: N4-tert-butyl-5-nitro-N6-sec-butyl-pyrimidine-4,6-diamine CAS Name: N6-butan-2-yl-N4-tert-butyl-5-nitropyrimidine-4,6-diamine IUPAC Name: 6-N-butan-2-yl-4-N-tert-butyl-5-nitropyrimidine-4,6-diamine Traditional Name: tert-butyl-[5-nitro-6-(sec-butylamino)pyrimidin-4-yl]amine Formula: C12H21N5O2 MolecularWeight: 267.32744

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC1=C(C(=NC=N1)NC(C)(C)C)[N+](=O)[O-]

Isomeric SMILES

CCC(C)NC1=C(C(=NC=N1)NC(C)(C)C)[N+](=O)[O-]

InChI

InChI=1S/C12H21N5O2/c1-6-8(2)15-10-9(17(18)19)11(14-7-13-10)16-12(3,4)5/h7-8H,6H2,1-5H3,(H2,13,14,15,16)