2-[[3-bromanyl-5-(trifluoromethyl)phenyl]methylsulfonyl-prop-2-enyl-amino]ethanamide

Systemtic Name: 2-[[3-bromanyl-5-(trifluoromethyl)phenyl]methylsulfonyl-prop-2-enyl-amino]ethanamide Openeye Name: 2-[allyl-[[3-bromo-5-(trifluoromethyl)phenyl]methylsulfonyl]amino]acetamide CAS Name: 2-[[3-bromo-5-(trifluoromethyl)phenyl]methylsulfonyl-prop-2-enylamino]acetamide IUPAC Name: 2-[[3-bromo-5-(trifluoromethyl)phenyl]methylsulfonyl-prop-2-enylamino]acetamide Traditional Name: 2-[allyl-[3-bromo-5-(trifluoromethyl)benzyl]sulfonyl-amino]acetamide Formula: C13H14BrF3N2O3S MolecularWeight: 415.22607

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H14BrF3N2O3S/c1-2-3-19(7-12(18)20)23(21,22)8-9-4-10(13(15,16)17)6-11(14)5-9/h2,4-6H,1,3,7-8H2,(H2,18,20)