N6-butyl-N4,N4-diethyl-5-nitro-pyrimidine-4,6-diamine

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=C(C(=NC=N1)N(CC)CC)[N+](=O)[O-]

Isomeric SMILES

CCCCNC1=C(C(=NC=N1)N(CC)CC)[N+](=O)[O-]

InChI

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