2-(2,1,3-benzoxadiazol-4-yl)ethanethioamide

Systemtic Name: 2-(2,1,3-benzoxadiazol-4-yl)ethanethioamide Openeye Name: 2-(2,1,3-benzoxadiazol-4-yl)thioacetamide CAS Name: 2-(2,1,3-benzoxadiazol-4-yl)ethanethioamide IUPAC Name: 2-(2,1,3-benzoxadiazol-4-yl)ethanethioamide Traditional Name: 2-benzofurazan-4-ylthioacetamide Formula: C8H7N3OS MolecularWeight: 193.22568

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=NON=C2C(=C1)CC(=S)N

Isomeric SMILES

C1=CC2=NON=C2C(=C1)CC(=S)N

InChI

InChI=1S/C8H7N3OS/c9-7(13)4-5-2-1-3-6-8(5)11-12-10-6/h1-3H,4H2,(H2,9,13)