2-[[3,4-bis(bromanyl)-2-fluoranyl-phenyl]methylsulfonyl-hexyl-amino]ethanethioamide

Systemtic Name: 2-[[3,4-bis(bromanyl)-2-fluoranyl-phenyl]methylsulfonyl-hexyl-amino]ethanethioamide Openeye Name: 2-[(3,4-dibromo-2-fluoro-phenyl)methylsulfonyl-hexyl-amino]thioacetamide CAS Name: 2-[(3,4-dibromo-2-fluorophenyl)methylsulfonyl-hexylamino]ethanethioamide IUPAC Name: 2-[(3,4-dibromo-2-fluorophenyl)methylsulfonyl-hexylamino]ethanethioamide Traditional Name: 2-[(3,4-dibromo-2-fluoro-benzyl)sulfonyl-hexyl-amino]thioacetamide Formula: C15H21Br2FN2O2S2 MolecularWeight: 504.275843

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H21Br2FN2O2S2/c1-2-3-4-5-8-20(9-13(19)23)24(21,22)10-11-6-7-12(16)14(17)15(11)18/h6-7H,2-5,8-10H2,1H3,(H2,19,23)