1-(3-methyl-5-methylsulfanyl-1,2-benzothiazol-7-yl)ethanone

Systemtic Name: 1-(3-methyl-5-methylsulfanyl-1,2-benzothiazol-7-yl)ethanone Openeye Name: 1-(3-methyl-5-methylsulfanyl-1,2-benzothiazol-7-yl)ethanone CAS Name: 1-[3-methyl-5-(methylthio)-1,2-benzothiazol-7-yl]ethanone IUPAC Name: 1-(3-methyl-5-methylsulfanyl-1,2-benzothiazol-7-yl)ethanone Traditional Name: 1-[3-methyl-5-(methylthio)-1,2-benzothiazol-7-yl]ethanone Formula: C11H11NOS2 MolecularWeight: 237.34114

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NSC2=C(C=C(C=C12)SC)C(=O)C

Isomeric SMILES

CC1=NSC2=C(C=C(C=C12)SC)C(=O)C

InChI

InChI=1S/C11H11NOS2/c1-6-9-4-8(14-3)5-10(7(2)13)11(9)15-12-6/h4-5H,1-3H3