5-nitro-6-quinolin-8-ylsulfanyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)pyrimidin-4-amine

Systemtic Name: 5-nitro-6-quinolin-8-ylsulfanyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)pyrimidin-4-amine Openeye Name: 5-nitro-6-(8-quinolylsulfanyl)-N-(2,2,6,6-tetramethyl-4-piperidyl)pyrimidin-4-amine CAS Name: 5-nitro-6-(8-quinolinylthio)-N-(2,2,6,6-tetramethyl-4-piperidinyl)-4-pyrimidinamine IUPAC Name: 5-nitro-6-quinolin-8-ylsulfanyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)pyrimidin-4-amine Traditional Name: [5-nitro-6-(8-quinolylthio)pyrimidin-4-yl]-(2,2,6,6-tetramethyl-4-piperidyl)amine Formula: C22H26N6O2S MolecularWeight: 438.54584

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(CC(N1)(C)C)NC2=C(C(=NC=N2)SC3=CC=CC4=C3N=CC=C4)[N+](=O)[O-])C

Isomeric SMILES

CC1(CC(CC(N1)(C)C)NC2=C(C(=NC=N2)SC3=CC=CC4=C3N=CC=C4)[N+](=O)[O-])C

InChI

InChI=1S/C22H26N6O2S/c1-21(2)11-15(12-22(3,4)27-21)26-19-18(28(29)30)20(25-13-24-19)31-16-9-5-7-14-8-6-10-23-17(14)16/h5-10,13,15,27H,11-12H2,1-4H3,(H,24,25,26)