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

Systemtic Name: 5-nitro-N4-(phenylmethyl)-N4-pyridin-2-yl-N6-(2,2,6,6-tetramethylpiperidin-4-yl)pyrimidine-4,6-diamine Openeye Name: N4-benzyl-5-nitro-N4-(2-pyridyl)-N6-(2,2,6,6-tetramethyl-4-piperidyl)pyrimidine-4,6-diamine CAS Name: 5-nitro-N4-(phenylmethyl)-N4-(2-pyridinyl)-N6-(2,2,6,6-tetramethyl-4-piperidinyl)pyrimidine-4,6-diamine IUPAC Name: 4-N-benzyl-5-nitro-4-N-pyridin-2-yl-6-N-(2,2,6,6-tetramethylpiperidin-4-yl)pyrimidine-4,6-diamine Traditional Name: benzyl-[5-nitro-6-[(2,2,6,6-tetramethyl-4-piperidyl)amino]pyrimidin-4-yl]-(2-pyridyl)amine Formula: C25H31N7O2 MolecularWeight: 461.55934

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(CC(N1)(C)C)NC2=C(C(=NC=N2)N(CC3=CC=CC=C3)C4=CC=CC=N4)[N+](=O)[O-])C

Isomeric SMILES

CC1(CC(CC(N1)(C)C)NC2=C(C(=NC=N2)N(CC3=CC=CC=C3)C4=CC=CC=N4)[N+](=O)[O-])C

InChI

InChI=1S/C25H31N7O2/c1-24(2)14-19(15-25(3,4)30-24)29-22-21(32(33)34)23(28-17-27-22)31(20-12-8-9-13-26-20)16-18-10-6-5-7-11-18/h5-13,17,19,30H,14-16H2,1-4H3,(H,27,28,29)