N-methyl-6-morpholin-4-yl-5-nitro-N-phenethyl-pyrimidin-4-amine

Systemtic Name: N-methyl-6-morpholin-4-yl-5-nitro-N-phenethyl-pyrimidin-4-amine Openeye Name: N-methyl-6-morpholino-5-nitro-N-phenethyl-pyrimidin-4-amine CAS Name: N-methyl-6-(4-morpholinyl)-5-nitro-N-phenethyl-4-pyrimidinamine IUPAC Name: N-methyl-6-morpholin-4-yl-5-nitro-N-phenethylpyrimidin-4-amine Traditional Name: methyl-(6-morpholino-5-nitro-pyrimidin-4-yl)-phenethyl-amine Formula: C17H21N5O3 MolecularWeight: 343.38034

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CCC1=CC=CC=C1)C2=NC=NC(=C2[N+](=O)[O-])N3CCOCC3

Isomeric SMILES

CN(CCC1=CC=CC=C1)C2=NC=NC(=C2[N+](=O)[O-])N3CCOCC3

InChI

InChI=1S/C17H21N5O3/c1-20(8-7-14-5-3-2-4-6-14)16-15(22(23)24)17(19-13-18-16)21-9-11-25-12-10-21/h2-6,13H,7-12H2,1H3