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

Systemtic Name: 2-[methyl(thiolan-3-yl)amino]-5-(trifluoromethyl)benzenecarbonitrile Openeye Name: 2-[methyl(tetrahydrothiophen-3-yl)amino]-5-(trifluoromethyl)benzonitrile CAS Name: 2-[methyl(3-thiolanyl)amino]-5-(trifluoromethyl)benzonitrile IUPAC Name: 2-[methyl(thiolan-3-yl)amino]-5-(trifluoromethyl)benzonitrile Traditional Name: 2-[methyl(tetrahydrothiophen-3-yl)amino]-5-(trifluoromethyl)benzonitrile Formula: C13H13F3N2S MolecularWeight: 286.31593

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H13F3N2S/c1-18(11-4-5-19-8-11)12-3-2-10(13(14,15)16)6-9(12)7-17/h2-3,6,11H,4-5,8H2,1H3