2-[[3-[bis(fluoranyl)methyl]phenyl]methylsulfonyl-butyl-amino]ethanethioamide

Systemtic Name: 2-[[3-[bis(fluoranyl)methyl]phenyl]methylsulfonyl-butyl-amino]ethanethioamide Openeye Name: 2-[butyl-[[3-(difluoromethyl)phenyl]methylsulfonyl]amino]thioacetamide CAS Name: 2-[butyl-[[3-(difluoromethyl)phenyl]methylsulfonyl]amino]ethanethioamide IUPAC Name: 2-[butyl-[[3-(difluoromethyl)phenyl]methylsulfonyl]amino]ethanethioamide Traditional Name: 2-[butyl-[3-(difluoromethyl)benzyl]sulfonyl-amino]thioacetamide Formula: C14H20F2N2O2S2 MolecularWeight: 350.447606

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H20F2N2O2S2/c1-2-3-7-18(9-13(17)21)22(19,20)10-11-5-4-6-12(8-11)14(15)16/h4-6,8,14H,2-3,7,9-10H2,1H3,(H2,17,21)