N4-butyl-N4-methyl-5-nitro-N6-prop-2-enyl-pyrimidine-4,6-diamine

Systemtic Name: N4-butyl-N4-methyl-5-nitro-N6-prop-2-enyl-pyrimidine-4,6-diamine Openeye Name: N6-allyl-N4-butyl-N4-methyl-5-nitro-pyrimidine-4,6-diamine CAS Name: N4-butyl-N4-methyl-5-nitro-N6-prop-2-enylpyrimidine-4,6-diamine IUPAC Name: 4-N-butyl-4-N-methyl-5-nitro-6-N-prop-2-enylpyrimidine-4,6-diamine Traditional Name: [6-(allylamino)-5-nitro-pyrimidin-4-yl]-butyl-methyl-amine Formula: C12H19N5O2 MolecularWeight: 265.31156

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H19N5O2/c1-4-6-8-16(3)12-10(17(18)19)11(13-7-5-2)14-9-15-12/h5,9H,2,4,6-8H2,1,3H3,(H,13,14,15)