N4-ethyl-5-nitro-N6-(oxolan-2-ylmethyl)-N4-phenyl-pyrimidine-4,6-diamine

Systemtic Name: N4-ethyl-5-nitro-N6-(oxolan-2-ylmethyl)-N4-phenyl-pyrimidine-4,6-diamine Openeye Name: N4-ethyl-5-nitro-N4-phenyl-N6-(tetrahydrofuran-2-ylmethyl)pyrimidine-4,6-diamine CAS Name: N4-ethyl-5-nitro-N6-(2-oxolanylmethyl)-N4-phenylpyrimidine-4,6-diamine IUPAC Name: 4-N-ethyl-5-nitro-6-N-(oxolan-2-ylmethyl)-4-N-phenylpyrimidine-4,6-diamine Traditional Name: ethyl-[5-nitro-6-(tetrahydrofurfurylamino)pyrimidin-4-yl]-phenyl-amine Formula: C17H21N5O3 MolecularWeight: 343.38034

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=CC=C1)C2=NC=NC(=C2[N+](=O)[O-])NCC3CCCO3

Isomeric SMILES

CCN(C1=CC=CC=C1)C2=NC=NC(=C2[N+](=O)[O-])NCC3CCCO3

InChI

InChI=1S/C17H21N5O3/c1-2-21(13-7-4-3-5-8-13)17-15(22(23)24)16(19-12-20-17)18-11-14-9-6-10-25-14/h3-5,7-8,12,14H,2,6,9-11H2,1H3,(H,18,19,20)