6-(2-ethylpiperidin-1-yl)-5-nitro-N-phenethyl-pyrimidin-4-amine

Systemtic Name: 6-(2-ethylpiperidin-1-yl)-5-nitro-N-phenethyl-pyrimidin-4-amine Openeye Name: 6-(2-ethyl-1-piperidyl)-5-nitro-N-phenethyl-pyrimidin-4-amine CAS Name: 6-(2-ethyl-1-piperidinyl)-5-nitro-N-phenethyl-4-pyrimidinamine IUPAC Name: 6-(2-ethylpiperidin-1-yl)-5-nitro-N-phenethylpyrimidin-4-amine Traditional Name: [6-(2-ethylpiperidino)-5-nitro-pyrimidin-4-yl]-phenethyl-amine Formula: C19H25N5O2 MolecularWeight: 355.4341

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCCN1C2=C(C(=NC=N2)NCCC3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CCC1CCCCN1C2=C(C(=NC=N2)NCCC3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H25N5O2/c1-2-16-10-6-7-13-23(16)19-17(24(25)26)18(21-14-22-19)20-12-11-15-8-4-3-5-9-15/h3-5,8-9,14,16H,2,6-7,10-13H2,1H3,(H,20,21,22)