2-methyl-8-methylsulfanyl-4,5-dihydrothieno[3,4-e][1,3]benzothiazole-6-carboxylic acid

Systemtic Name: 2-methyl-8-methylsulfanyl-4,5-dihydrothieno[3,4-e][1,3]benzothiazole-6-carboxylic acid Openeye Name: 2-methyl-8-methylsulfanyl-4,5-dihydrothieno[3,4-e][1,3]benzothiazole-6-carboxylic acid CAS Name: 2-methyl-8-(methylthio)-4,5-dihydrothieno[3,4-e][1,3]benzothiazole-6-carboxylic acid IUPAC Name: 2-methyl-8-methylsulfanyl-4,5-dihydrothieno[3,4-e][1,3]benzothiazole-6-carboxylic acid Traditional Name: 2-methyl-8-(methylthio)-4,5-dihydrothieno[3,4-e][1,3]benzothiazole-6-carboxylic acid Formula: C12H11NO2S3 MolecularWeight: 297.41624

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(S1)CCC3=C(SC(=C32)SC)C(=O)O

Isomeric SMILES

CC1=NC2=C(S1)CCC3=C(SC(=C32)SC)C(=O)O

InChI

InChI=1S/C12H11NO2S3/c1-5-13-9-7(17-5)4-3-6-8(9)12(16-2)18-10(6)11(14)15/h3-4H2,1-2H3,(H,14,15)