2-(4-methylsulfonylphenyl)-N-(2-thiophen-2-ylethyl)-6-(trifluoromethyl)pyrimidin-4-amine

Systemtic Name: 2-(4-methylsulfonylphenyl)-N-(2-thiophen-2-ylethyl)-6-(trifluoromethyl)pyrimidin-4-amine Openeye Name: 2-(4-methylsulfonylphenyl)-N-[2-(2-thienyl)ethyl]-6-(trifluoromethyl)pyrimidin-4-amine CAS Name: 2-(4-methylsulfonylphenyl)-N-(2-thiophen-2-ylethyl)-6-(trifluoromethyl)-4-pyrimidinamine IUPAC Name: 2-(4-methylsulfonylphenyl)-N-(2-thiophen-2-ylethyl)-6-(trifluoromethyl)pyrimidin-4-amine Traditional Name: [2-(4-mesylphenyl)-6-(trifluoromethyl)pyrimidin-4-yl]-[2-(2-thienyl)ethyl]amine Formula: C18H16F3N3O2S2 MolecularWeight: 427.46375

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C2=NC(=CC(=N2)NCCC3=CC=CS3)C(F)(F)F

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C2=NC(=CC(=N2)NCCC3=CC=CS3)C(F)(F)F

InChI

InChI=1S/C18H16F3N3O2S2/c1-28(25,26)14-6-4-12(5-7-14)17-23-15(18(19,20)21)11-16(24-17)22-9-8-13-3-2-10-27-13/h2-7,10-11H,8-9H2,1H3,(H,22,23,24)