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

Systemtic Name: 6-(2-ethylpiperidin-1-yl)-5-nitro-N-(phenylmethyl)-N-pyridin-2-yl-pyrimidin-4-amine Openeye Name: N-benzyl-6-(2-ethyl-1-piperidyl)-5-nitro-N-(2-pyridyl)pyrimidin-4-amine CAS Name: 6-(2-ethyl-1-piperidinyl)-5-nitro-N-(phenylmethyl)-N-(2-pyridinyl)-4-pyrimidinamine IUPAC Name: N-benzyl-6-(2-ethylpiperidin-1-yl)-5-nitro-N-pyridin-2-ylpyrimidin-4-amine Traditional Name: benzyl-[6-(2-ethylpiperidino)-5-nitro-pyrimidin-4-yl]-(2-pyridyl)amine Formula: C23H26N6O2 MolecularWeight: 418.49154

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCCN1C2=C(C(=NC=N2)N(CC3=CC=CC=C3)C4=CC=CC=N4)[N+](=O)[O-]

Isomeric SMILES

CCC1CCCCN1C2=C(C(=NC=N2)N(CC3=CC=CC=C3)C4=CC=CC=N4)[N+](=O)[O-]

InChI

InChI=1S/C23H26N6O2/c1-2-19-12-7-9-15-27(19)22-21(29(30)31)23(26-17-25-22)28(20-13-6-8-14-24-20)16-18-10-4-3-5-11-18/h3-6,8,10-11,13-14,17,19H,2,7,9,12,15-16H2,1H3