2-[[3-(fluoranylmethyl)phenyl]methylsulfonyl-prop-2-enyl-amino]ethanethioamide

Systemtic Name: 2-[[3-(fluoranylmethyl)phenyl]methylsulfonyl-prop-2-enyl-amino]ethanethioamide Openeye Name: 2-[allyl-[[3-(fluoromethyl)phenyl]methylsulfonyl]amino]thioacetamide CAS Name: 2-[[3-(fluoromethyl)phenyl]methylsulfonyl-prop-2-enylamino]ethanethioamide IUPAC Name: 2-[[3-(fluoromethyl)phenyl]methylsulfonyl-prop-2-enylamino]ethanethioamide Traditional Name: 2-[allyl-[3-(fluoromethyl)benzyl]sulfonyl-amino]thioacetamide Formula: C13H17FN2O2S2 MolecularWeight: 316.414683

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN(CC(=S)N)S(=O)(=O)CC1=CC=CC(=C1)CF

Isomeric SMILES

C=CCN(CC(=S)N)S(=O)(=O)CC1=CC=CC(=C1)CF

InChI

InChI=1S/C13H17FN2O2S2/c1-2-6-16(9-13(15)19)20(17,18)10-12-5-3-4-11(7-12)8-14/h2-5,7H,1,6,8-10H2,(H2,15,19)