N-[6-(2-ethylpiperidin-1-yl)-5-nitro-pyrimidin-4-yl]-2-methyl-quinolin-5-amine

Systemtic Name: N-[6-(2-ethylpiperidin-1-yl)-5-nitro-pyrimidin-4-yl]-2-methyl-quinolin-5-amine Openeye Name: N-[6-(2-ethyl-1-piperidyl)-5-nitro-pyrimidin-4-yl]-2-methyl-quinolin-5-amine CAS Name: N-[6-(2-ethyl-1-piperidinyl)-5-nitro-4-pyrimidinyl]-2-methyl-5-quinolinamine IUPAC Name: N-[6-(2-ethylpiperidin-1-yl)-5-nitropyrimidin-4-yl]-2-methylquinolin-5-amine Traditional Name: [6-(2-ethylpiperidino)-5-nitro-pyrimidin-4-yl]-(2-methyl-5-quinolyl)amine Formula: C21H24N6O2 MolecularWeight: 392.45426

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCCN1C2=C(C(=NC=N2)NC3=CC=CC4=C3C=CC(=N4)C)[N+](=O)[O-]

Isomeric SMILES

CCC1CCCCN1C2=C(C(=NC=N2)NC3=CC=CC4=C3C=CC(=N4)C)[N+](=O)[O-]

InChI

InChI=1S/C21H24N6O2/c1-3-15-7-4-5-12-26(15)21-19(27(28)29)20(22-13-23-21)25-18-9-6-8-17-16(18)11-10-14(2)24-17/h6,8-11,13,15H,3-5,7,12H2,1-2H3,(H,22,23,25)