5-methoxy-1,2-dimethyl-thieno[2,3-e][1,3]benzothiazol-1-ium

Systemtic Name: 5-methoxy-1,2-dimethyl-thieno[2,3-e][1,3]benzothiazol-1-ium Openeye Name: 5-methoxy-1,2-dimethyl-thieno[2,3-e][1,3]benzothiazol-1-ium CAS Name: 5-methoxy-1,2-dimethylthieno[2,3-e][1,3]benzothiazol-1-ium IUPAC Name: 5-methoxy-1,2-dimethylthieno[2,3-e][1,3]benzothiazol-1-ium Traditional Name: 5-methoxy-1,2-dimethyl-thieno[2,3-e][1,3]benzothiazol-1-ium Formula: C12H12NOS2+ MolecularWeight: 250.35978

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](C2=C(S1)C=C(C3=C2SC=C3)OC)C

Isomeric SMILES

CC1=[N+](C2=C(S1)C=C(C3=C2SC=C3)OC)C

InChI

InChI=1S/C12H12NOS2/c1-7-13(2)11-10(16-7)6-9(14-3)8-4-5-15-12(8)11/h4-6H,1-3H3/q+1