N-pyridin-3-yl-2-[2,4,6-tris(bromanyl)phenoxy]ethanethioamide

Systemtic Name: N-pyridin-3-yl-2-[2,4,6-tris(bromanyl)phenoxy]ethanethioamide Openeye Name: N-(3-pyridyl)-2-(2,4,6-tribromophenoxy)thioacetamide CAS Name: N-(3-pyridinyl)-2-(2,4,6-tribromophenoxy)ethanethioamide IUPAC Name: N-pyridin-3-yl-2-(2,4,6-tribromophenoxy)ethanethioamide Traditional Name: N-(3-pyridyl)-2-(2,4,6-tribromophenoxy)thioacetamide Formula: C13H9Br3N2OS MolecularWeight: 481.00036

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)NC(=S)COC2=C(C=C(C=C2Br)Br)Br

Isomeric SMILES

C1=CC(=CN=C1)NC(=S)COC2=C(C=C(C=C2Br)Br)Br

InChI

InChI=1S/C13H9Br3N2OS/c14-8-4-10(15)13(11(16)5-8)19-7-12(20)18-9-2-1-3-17-6-9/h1-6H,7H2,(H,18,20)