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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCCN1C2=C(C(=NC=N2)NC3=CC=CC=C3CC)[N+](=O)[O-]

Isomeric SMILES

CCC1CCCCN1C2=C(C(=NC=N2)NC3=CC=CC=C3CC)[N+](=O)[O-]

InChI

InChI=1S/C19H25N5O2/c1-3-14-9-5-6-11-16(14)22-18-17(24(25)26)19(21-13-20-18)23-12-8-7-10-15(23)4-2/h5-6,9,11,13,15H,3-4,7-8,10,12H2,1-2H3,(H,20,21,22)