N-(cyclobutylmethyl)-4-(4-methylsulfonylphenyl)-6-(trifluoromethyl)pyrimidin-2-amine

Systemtic Name: N-(cyclobutylmethyl)-4-(4-methylsulfonylphenyl)-6-(trifluoromethyl)pyrimidin-2-amine Openeye Name: N-(cyclobutylmethyl)-4-(4-methylsulfonylphenyl)-6-(trifluoromethyl)pyrimidin-2-amine CAS Name: N-(cyclobutylmethyl)-4-(4-methylsulfonylphenyl)-6-(trifluoromethyl)-2-pyrimidinamine IUPAC Name: N-(cyclobutylmethyl)-4-(4-methylsulfonylphenyl)-6-(trifluoromethyl)pyrimidin-2-amine Traditional Name: cyclobutylmethyl-[4-(4-mesylphenyl)-6-(trifluoromethyl)pyrimidin-2-yl]amine Formula: C17H18F3N3O2S MolecularWeight: 385.40393

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C2=CC(=NC(=N2)NCC3CCC3)C(F)(F)F

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C2=CC(=NC(=N2)NCC3CCC3)C(F)(F)F

InChI

InChI=1S/C17H18F3N3O2S/c1-26(24,25)13-7-5-12(6-8-13)14-9-15(17(18,19)20)23-16(22-14)21-10-11-3-2-4-11/h5-9,11H,2-4,10H2,1H3,(H,21,22,23)