2-[4-(5-methylthiophen-2-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanylethylazanium

Systemtic Name: 2-[4-(5-methylthiophen-2-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanylethylazanium Openeye Name: 2-[4-(5-methyl-2-thienyl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanylethylammonium CAS Name: 2-[[4-(5-methyl-2-thiophenyl)-6-(trifluoromethyl)-2-pyrimidinyl]thio]ethylammonium IUPAC Name: 2-[4-(5-methylthiophen-2-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanylethylazanium Traditional Name: 2-[[4-(5-methyl-2-thienyl)-6-(trifluoromethyl)pyrimidin-2-yl]thio]ethylammonium Formula: C12H13F3N3S2+ MolecularWeight: 320.37693

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C2=CC(=NC(=N2)SCC[NH3+])C(F)(F)F

Isomeric SMILES

CC1=CC=C(S1)C2=CC(=NC(=N2)SCC[NH3+])C(F)(F)F

InChI

InChI=1S/C12H12F3N3S2/c1-7-2-3-9(20-7)8-6-10(12(13,14)15)18-11(17-8)19-5-4-16/h2-3,6H,4-5,16H2,1H3/p+1