2-[(3-bromophenyl)methylsulfonyl-hexyl-amino]ethanethioamide

Systemtic Name: 2-[(3-bromophenyl)methylsulfonyl-hexyl-amino]ethanethioamide Openeye Name: 2-[(3-bromophenyl)methylsulfonyl-hexyl-amino]thioacetamide CAS Name: 2-[(3-bromophenyl)methylsulfonyl-hexylamino]ethanethioamide IUPAC Name: 2-[(3-bromophenyl)methylsulfonyl-hexylamino]ethanethioamide Traditional Name: 2-[(3-bromobenzyl)sulfonyl-hexyl-amino]thioacetamide Formula: C15H23BrN2O2S2 MolecularWeight: 407.38932

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H23BrN2O2S2/c1-2-3-4-5-9-18(11-15(17)21)22(19,20)12-13-7-6-8-14(16)10-13/h6-8,10H,2-5,9,11-12H2,1H3,(H2,17,21)