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

Systemtic Name: N-(2-ethylphenyl)-6-(4-methylpiperidin-1-yl)-5-nitro-pyrimidin-4-amine Openeye Name: N-(2-ethylphenyl)-6-(4-methyl-1-piperidyl)-5-nitro-pyrimidin-4-amine CAS Name: N-(2-ethylphenyl)-6-(4-methyl-1-piperidinyl)-5-nitro-4-pyrimidinamine IUPAC Name: N-(2-ethylphenyl)-6-(4-methylpiperidin-1-yl)-5-nitropyrimidin-4-amine Traditional Name: (2-ethylphenyl)-[6-(4-methylpiperidino)-5-nitro-pyrimidin-4-yl]amine Formula: C18H23N5O2 MolecularWeight: 341.40752

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC2=NC=NC(=C2[N+](=O)[O-])N3CCC(CC3)C

Isomeric SMILES

CCC1=CC=CC=C1NC2=NC=NC(=C2[N+](=O)[O-])N3CCC(CC3)C

InChI

InChI=1S/C18H23N5O2/c1-3-14-6-4-5-7-15(14)21-17-16(23(24)25)18(20-12-19-17)22-10-8-13(2)9-11-22/h4-7,12-13H,3,8-11H2,1-2H3,(H,19,20,21)