2-[methyl(thiolan-3-yl)amino]-5-(trifluoromethyl)benzenecarbothioamide

Systemtic Name: 2-[methyl(thiolan-3-yl)amino]-5-(trifluoromethyl)benzenecarbothioamide Openeye Name: 2-[methyl(tetrahydrothiophen-3-yl)amino]-5-(trifluoromethyl)benzenecarbothioamide CAS Name: 2-[methyl(3-thiolanyl)amino]-5-(trifluoromethyl)benzenecarbothioamide IUPAC Name: 2-[methyl(thiolan-3-yl)amino]-5-(trifluoromethyl)benzenecarbothioamide Traditional Name: 2-[methyl(tetrahydrothiophen-3-yl)amino]-5-(trifluoromethyl)thiobenzamide Formula: C13H15F3N2S2 MolecularWeight: 320.39681

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCSC1)C2=C(C=C(C=C2)C(F)(F)F)C(=S)N

Isomeric SMILES

CN(C1CCSC1)C2=C(C=C(C=C2)C(F)(F)F)C(=S)N

InChI

InChI=1S/C13H15F3N2S2/c1-18(9-4-5-20-7-9)11-3-2-8(13(14,15)16)6-10(11)12(17)19/h2-3,6,9H,4-5,7H2,1H3,(H2,17,19)