5-nitro-N4-(1-phenylethyl)-N6-(2,2,6,6-tetramethylpiperidin-4-yl)pyrimidine-4,6-diamine

Systemtic Name: 5-nitro-N4-(1-phenylethyl)-N6-(2,2,6,6-tetramethylpiperidin-4-yl)pyrimidine-4,6-diamine Openeye Name: 5-nitro-N4-(1-phenylethyl)-N6-(2,2,6,6-tetramethyl-4-piperidyl)pyrimidine-4,6-diamine CAS Name: 5-nitro-N4-(1-phenylethyl)-N6-(2,2,6,6-tetramethyl-4-piperidinyl)pyrimidine-4,6-diamine IUPAC Name: 5-nitro-4-N-(1-phenylethyl)-6-N-(2,2,6,6-tetramethylpiperidin-4-yl)pyrimidine-4,6-diamine Traditional Name: [5-nitro-6-(1-phenylethylamino)pyrimidin-4-yl]-(2,2,6,6-tetramethyl-4-piperidyl)amine Formula: C21H30N6O2 MolecularWeight: 398.5019

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC2=NC=NC(=C2[N+](=O)[O-])NC3CC(NC(C3)(C)C)(C)C

Isomeric SMILES

CC(C1=CC=CC=C1)NC2=NC=NC(=C2[N+](=O)[O-])NC3CC(NC(C3)(C)C)(C)C

InChI

InChI=1S/C21H30N6O2/c1-14(15-9-7-6-8-10-15)24-18-17(27(28)29)19(23-13-22-18)25-16-11-20(2,3)26-21(4,5)12-16/h6-10,13-14,16,26H,11-12H2,1-5H3,(H2,22,23,24,25)