N4-butyl-N4-methyl-5-nitro-N6-(1-phenylethyl)pyrimidine-4,6-diamine

Systemtic Name: N4-butyl-N4-methyl-5-nitro-N6-(1-phenylethyl)pyrimidine-4,6-diamine Openeye Name: N4-butyl-N4-methyl-5-nitro-N6-(1-phenylethyl)pyrimidine-4,6-diamine CAS Name: N4-butyl-N4-methyl-5-nitro-N6-(1-phenylethyl)pyrimidine-4,6-diamine IUPAC Name: 4-N-butyl-4-N-methyl-5-nitro-6-N-(1-phenylethyl)pyrimidine-4,6-diamine Traditional Name: butyl-methyl-[5-nitro-6-(1-phenylethylamino)pyrimidin-4-yl]amine Formula: C17H23N5O2 MolecularWeight: 329.39682

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C)C1=NC=NC(=C1[N+](=O)[O-])NC(C)C2=CC=CC=C2

Isomeric SMILES

CCCCN(C)C1=NC=NC(=C1[N+](=O)[O-])NC(C)C2=CC=CC=C2

InChI

InChI=1S/C17H23N5O2/c1-4-5-11-21(3)17-15(22(23)24)16(18-12-19-17)20-13(2)14-9-7-6-8-10-14/h6-10,12-13H,4-5,11H2,1-3H3,(H,18,19,20)