2-[[3-methoxy-5-(trifluoromethyl)phenyl]methylsulfonyl-prop-2-enyl-amino]ethanethioamide

Systemtic Name: 2-[[3-methoxy-5-(trifluoromethyl)phenyl]methylsulfonyl-prop-2-enyl-amino]ethanethioamide Openeye Name: 2-[allyl-[[3-methoxy-5-(trifluoromethyl)phenyl]methylsulfonyl]amino]thioacetamide CAS Name: 2-[[3-methoxy-5-(trifluoromethyl)phenyl]methylsulfonyl-prop-2-enylamino]ethanethioamide IUPAC Name: 2-[[3-methoxy-5-(trifluoromethyl)phenyl]methylsulfonyl-prop-2-enylamino]ethanethioamide Traditional Name: 2-[allyl-[3-methoxy-5-(trifluoromethyl)benzyl]sulfonyl-amino]thioacetamide Formula: C14H17F3N2O3S2 MolecularWeight: 382.42159

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)C(F)(F)F)CS(=O)(=O)N(CC=C)CC(=S)N

Isomeric SMILES

COC1=CC(=CC(=C1)C(F)(F)F)CS(=O)(=O)N(CC=C)CC(=S)N

InChI

InChI=1S/C14H17F3N2O3S2/c1-3-4-19(8-13(18)23)24(20,21)9-10-5-11(14(15,16)17)7-12(6-10)22-2/h3,5-7H,1,4,8-9H2,2H3,(H2,18,23)