N6-(4-methyl-1,3-benzothiazol-2-yl)-5-nitro-N4-(2,2,6,6-tetramethylpiperidin-4-yl)pyrimidine-4,6-diamine

Systemtic Name: N6-(4-methyl-1,3-benzothiazol-2-yl)-5-nitro-N4-(2,2,6,6-tetramethylpiperidin-4-yl)pyrimidine-4,6-diamine Openeye Name: N6-(4-methyl-1,3-benzothiazol-2-yl)-5-nitro-N4-(2,2,6,6-tetramethyl-4-piperidyl)pyrimidine-4,6-diamine CAS Name: N6-(4-methyl-1,3-benzothiazol-2-yl)-5-nitro-N4-(2,2,6,6-tetramethyl-4-piperidinyl)pyrimidine-4,6-diamine IUPAC Name: 6-N-(4-methyl-1,3-benzothiazol-2-yl)-5-nitro-4-N-(2,2,6,6-tetramethylpiperidin-4-yl)pyrimidine-4,6-diamine Traditional Name: (4-methyl-1,3-benzothiazol-2-yl)-[5-nitro-6-[(2,2,6,6-tetramethyl-4-piperidyl)amino]pyrimidin-4-yl]amine Formula: C21H27N7O2S MolecularWeight: 441.54978

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)SC(=N2)NC3=C(C(=NC=N3)NC4CC(NC(C4)(C)C)(C)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C2C(=CC=C1)SC(=N2)NC3=C(C(=NC=N3)NC4CC(NC(C4)(C)C)(C)C)[N+](=O)[O-]

InChI

InChI=1S/C21H27N7O2S/c1-12-7-6-8-14-15(12)25-19(31-14)26-18-16(28(29)30)17(22-11-23-18)24-13-9-20(2,3)27-21(4,5)10-13/h6-8,11,13,27H,9-10H2,1-5H3,(H2,22,23,24,25,26)