S-[3-bromanyl-1-(2-methylprop-1-enyl)-4-oxidanylidene-azetidin-2-yl] ethanethioate

Systemtic Name: S-[3-bromanyl-1-(2-methylprop-1-enyl)-4-oxidanylidene-azetidin-2-yl] ethanethioate Openeye Name: S-[3-bromo-1-(2-methylprop-1-enyl)-4-oxo-azetidin-2-yl] ethanethioate CAS Name: ethanethioic acid S-[3-bromo-1-(2-methylprop-1-enyl)-4-oxo-2-azetidinyl] ester IUPAC Name: S-[3-bromo-1-(2-methylprop-1-enyl)-4-oxoazetidin-2-yl] ethanethioate Traditional Name: ethanethioic acid S-[3-bromo-4-keto-1-(2-methylprop-1-enyl)azetidin-2-yl] ester Formula: C9H12BrNO2S MolecularWeight: 278.16608

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=CN1C(C(C1=O)Br)SC(=O)C)C

Isomeric SMILES

CC(=CN1C(C(C1=O)Br)SC(=O)C)C

InChI

InChI=1S/C9H12BrNO2S/c1-5(2)4-11-8(13)7(10)9(11)14-6(3)12/h4,7,9H,1-3H3