5-nitro-N6-quinolin-5-yl-N4-(2,2,6,6-tetramethylpiperidin-4-yl)pyrimidine-4,6-diamine

Systemtic Name: 5-nitro-N6-quinolin-5-yl-N4-(2,2,6,6-tetramethylpiperidin-4-yl)pyrimidine-4,6-diamine Openeye Name: 5-nitro-N6-(5-quinolyl)-N4-(2,2,6,6-tetramethyl-4-piperidyl)pyrimidine-4,6-diamine CAS Name: 5-nitro-N6-(5-quinolinyl)-N4-(2,2,6,6-tetramethyl-4-piperidinyl)pyrimidine-4,6-diamine IUPAC Name: 5-nitro-6-N-quinolin-5-yl-4-N-(2,2,6,6-tetramethylpiperidin-4-yl)pyrimidine-4,6-diamine Traditional Name: [5-nitro-6-(5-quinolylamino)pyrimidin-4-yl]-(2,2,6,6-tetramethyl-4-piperidyl)amine Formula: C22H27N7O2 MolecularWeight: 421.49548

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(CC(N1)(C)C)NC2=NC=NC(=C2[N+](=O)[O-])NC3=CC=CC4=C3C=CC=N4)C

Isomeric SMILES

CC1(CC(CC(N1)(C)C)NC2=NC=NC(=C2[N+](=O)[O-])NC3=CC=CC4=C3C=CC=N4)C

InChI

InChI=1S/C22H27N7O2/c1-21(2)11-14(12-22(3,4)28-21)26-19-18(29(30)31)20(25-13-24-19)27-17-9-5-8-16-15(17)7-6-10-23-16/h5-10,13-14,28H,11-12H2,1-4H3,(H2,24,25,26,27)