N,N-dimethyl-9-(2-methylsulfonylpyrimidin-4-yl)-2-(trifluoromethyl)purin-6-amine

Systemtic Name: N,N-dimethyl-9-(2-methylsulfonylpyrimidin-4-yl)-2-(trifluoromethyl)purin-6-amine Openeye Name: N,N-dimethyl-9-(2-methylsulfonylpyrimidin-4-yl)-2-(trifluoromethyl)purin-6-amine CAS Name: N,N-dimethyl-9-(2-methylsulfonyl-4-pyrimidinyl)-2-(trifluoromethyl)-6-purinamine IUPAC Name: N,N-dimethyl-9-(2-methylsulfonylpyrimidin-4-yl)-2-(trifluoromethyl)purin-6-amine Traditional Name: [9-(2-mesylpyrimidin-4-yl)-2-(trifluoromethyl)purin-6-yl]-dimethyl-amine Formula: C13H12F3N7O2S MolecularWeight: 387.34029

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=NC(=NC2=C1N=CN2C3=NC(=NC=C3)S(=O)(=O)C)C(F)(F)F

Isomeric SMILES

CN(C)C1=NC(=NC2=C1N=CN2C3=NC(=NC=C3)S(=O)(=O)C)C(F)(F)F

InChI

InChI=1S/C13H12F3N7O2S/c1-22(2)9-8-10(21-11(20-9)13(14,15)16)23(6-18-8)7-4-5-17-12(19-7)26(3,24)25/h4-6H,1-3H3