2-[[4-chloranyl-3-(trifluoromethyl)phenyl]methylsulfonyl-prop-2-enyl-amino]ethanethioamide

Systemtic Name: 2-[[4-chloranyl-3-(trifluoromethyl)phenyl]methylsulfonyl-prop-2-enyl-amino]ethanethioamide Openeye Name: 2-[allyl-[[4-chloro-3-(trifluoromethyl)phenyl]methylsulfonyl]amino]thioacetamide CAS Name: 2-[[4-chloro-3-(trifluoromethyl)phenyl]methylsulfonyl-prop-2-enylamino]ethanethioamide IUPAC Name: 2-[[4-chloro-3-(trifluoromethyl)phenyl]methylsulfonyl-prop-2-enylamino]ethanethioamide Traditional Name: 2-[allyl-[4-chloro-3-(trifluoromethyl)benzyl]sulfonyl-amino]thioacetamide Formula: C13H14ClF3N2O2S2 MolecularWeight: 386.84067

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CCN(CC(=S)N)S(=O)(=O)CC1=CC(=C(C=C1)Cl)C(F)(F)F

Isomeric SMILES

C=CCN(CC(=S)N)S(=O)(=O)CC1=CC(=C(C=C1)Cl)C(F)(F)F

InChI

InChI=1S/C13H14ClF3N2O2S2/c1-2-5-19(7-12(18)22)23(20,21)8-9-3-4-11(14)10(6-9)13(15,16)17/h2-4,6H,1,5,7-8H2,(H2,18,22)