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

Systemtic Name: N4-butan-2-yl-2-methyl-5-nitro-N6-propan-2-yl-pyrimidine-4,6-diamine Openeye Name: N6-isopropyl-2-methyl-5-nitro-N4-sec-butyl-pyrimidine-4,6-diamine CAS Name: N4-butan-2-yl-2-methyl-5-nitro-N6-propan-2-ylpyrimidine-4,6-diamine IUPAC Name: 4-N-butan-2-yl-2-methyl-5-nitro-6-N-propan-2-ylpyrimidine-4,6-diamine Traditional Name: isopropyl-[2-methyl-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=NC(=NC(=C1[N+](=O)[O-])NC(C)C)C

Isomeric SMILES

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

InChI

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