2-[[3-[bis(fluoranyl)methyl]phenyl]methylsulfonyl-prop-2-enyl-amino]ethanamide

Systemtic Name: 2-[[3-[bis(fluoranyl)methyl]phenyl]methylsulfonyl-prop-2-enyl-amino]ethanamide Openeye Name: 2-[allyl-[[3-(difluoromethyl)phenyl]methylsulfonyl]amino]acetamide CAS Name: 2-[[3-(difluoromethyl)phenyl]methylsulfonyl-prop-2-enylamino]acetamide IUPAC Name: 2-[[3-(difluoromethyl)phenyl]methylsulfonyl-prop-2-enylamino]acetamide Traditional Name: 2-[allyl-[3-(difluoromethyl)benzyl]sulfonyl-amino]acetamide Formula: C13H16F2N2O3S MolecularWeight: 318.339546

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16F2N2O3S/c1-2-6-17(8-12(16)18)21(19,20)9-10-4-3-5-11(7-10)13(14)15/h2-5,7,13H,1,6,8-9H2,(H2,16,18)