2-(4-methylsulfonylphenyl)-N-[(5-methylthiophen-2-yl)methyl]-6-(trifluoromethyl)pyrimidin-4-amine

Systemtic Name: 2-(4-methylsulfonylphenyl)-N-[(5-methylthiophen-2-yl)methyl]-6-(trifluoromethyl)pyrimidin-4-amine Openeye Name: 2-(4-methylsulfonylphenyl)-N-[(5-methyl-2-thienyl)methyl]-6-(trifluoromethyl)pyrimidin-4-amine CAS Name: 2-(4-methylsulfonylphenyl)-N-[(5-methyl-2-thiophenyl)methyl]-6-(trifluoromethyl)-4-pyrimidinamine IUPAC Name: 2-(4-methylsulfonylphenyl)-N-[(5-methylthiophen-2-yl)methyl]-6-(trifluoromethyl)pyrimidin-4-amine Traditional Name: [2-(4-mesylphenyl)-6-(trifluoromethyl)pyrimidin-4-yl]-[(5-methyl-2-thienyl)methyl]amine Formula: C18H16F3N3O2S2 MolecularWeight: 427.46375

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)CNC2=NC(=NC(=C2)C(F)(F)F)C3=CC=C(C=C3)S(=O)(=O)C

Isomeric SMILES

CC1=CC=C(S1)CNC2=NC(=NC(=C2)C(F)(F)F)C3=CC=C(C=C3)S(=O)(=O)C

InChI

InChI=1S/C18H16F3N3O2S2/c1-11-3-6-13(27-11)10-22-16-9-15(18(19,20)21)23-17(24-16)12-4-7-14(8-5-12)28(2,25)26/h3-9H,10H2,1-2H3,(H,22,23,24)