N4-butyl-N4-methyl-5-nitro-N6-propyl-pyrimidine-4,6-diamine

Systemtic Name: N4-butyl-N4-methyl-5-nitro-N6-propyl-pyrimidine-4,6-diamine Openeye Name: N4-butyl-N4-methyl-5-nitro-N6-propyl-pyrimidine-4,6-diamine CAS Name: N4-butyl-N4-methyl-5-nitro-N6-propylpyrimidine-4,6-diamine IUPAC Name: 4-N-butyl-4-N-methyl-5-nitro-6-N-propylpyrimidine-4,6-diamine Traditional Name: butyl-methyl-[5-nitro-6-(propylamino)pyrimidin-4-yl]amine Formula: C12H21N5O2 MolecularWeight: 267.32744

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C)C1=NC=NC(=C1[N+](=O)[O-])NCCC

Isomeric SMILES

CCCCN(C)C1=NC=NC(=C1[N+](=O)[O-])NCCC

InChI

InChI=1S/C12H21N5O2/c1-4-6-8-16(3)12-10(17(18)19)11(13-7-5-2)14-9-15-12/h9H,4-8H2,1-3H3,(H,13,14,15)