methyl 3-(2-methylthieno[2,3-e][1,3]benzothiazol-5-yl)oxysulfonylthiophene-2-carboxylate

Systemtic Name: methyl 3-(2-methylthieno[2,3-e][1,3]benzothiazol-5-yl)oxysulfonylthiophene-2-carboxylate Openeye Name: methyl 3-(2-methylthieno[2,3-e][1,3]benzothiazol-5-yl)oxysulfonylthiophene-2-carboxylate CAS Name: 3-[(2-methyl-5-thieno[2,3-e][1,3]benzothiazolyl)oxysulfonyl]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-(2-methylthieno[2,3-e][1,3]benzothiazol-5-yl)oxysulfonylthiophene-2-carboxylate Traditional Name: 3-(2-methylthieno[2,3-e][1,3]benzothiazol-5-yl)oxysulfonylthiophene-2-carboxylic acid methyl ester Formula: C16H11NO5S4 MolecularWeight: 425.52224

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(S1)C=C(C3=C2SC=C3)OS(=O)(=O)C4=C(SC=C4)C(=O)OC

Isomeric SMILES

CC1=NC2=C(S1)C=C(C3=C2SC=C3)OS(=O)(=O)C4=C(SC=C4)C(=O)OC

InChI

InChI=1S/C16H11NO5S4/c1-8-17-13-11(25-8)7-10(9-3-5-23-14(9)13)22-26(19,20)12-4-6-24-15(12)16(18)21-2/h3-7H,1-2H3