S-ethyl 2-(1,3-benzothiazol-2-yl)ethanethioate

Systemtic Name: S-ethyl 2-(1,3-benzothiazol-2-yl)ethanethioate Openeye Name: S-ethyl 2-(1,3-benzothiazol-2-yl)ethanethioate CAS Name: 2-(1,3-benzothiazol-2-yl)ethanethioic acid S-ethyl ester IUPAC Name: S-ethyl 2-(1,3-benzothiazol-2-yl)ethanethioate Traditional Name: 2-(1,3-benzothiazol-2-yl)ethanethioic acid S-ethyl ester Formula: C11H11NOS2 MolecularWeight: 237.34114

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCSC(=O)CC1=NC2=CC=CC=C2S1

Isomeric SMILES

CCSC(=O)CC1=NC2=CC=CC=C2S1

InChI

InChI=1S/C11H11NOS2/c1-2-14-11(13)7-10-12-8-5-3-4-6-9(8)15-10/h3-6H,2,7H2,1H3