4-(3,5-dimethylphenyl)sulfanylthieno[2,3-c]pyridine-2-carboxylic acid

Systemtic Name: 4-(3,5-dimethylphenyl)sulfanylthieno[2,3-c]pyridine-2-carboxylic acid Openeye Name: 4-(3,5-dimethylphenyl)sulfanylthieno[2,3-c]pyridine-2-carboxylic acid CAS Name: 4-[(3,5-dimethylphenyl)thio]-2-thieno[2,3-c]pyridinecarboxylic acid IUPAC Name: 4-(3,5-dimethylphenyl)sulfanylthieno[2,3-c]pyridine-2-carboxylic acid Traditional Name: 4-[(3,5-dimethylphenyl)thio]thieno[2,3-c]pyridine-2-carboxylic acid Formula: C16H13NO2S2 MolecularWeight: 315.40992

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)SC2=C3C=C(SC3=CN=C2)C(=O)O)C

Isomeric SMILES

CC1=CC(=CC(=C1)SC2=C3C=C(SC3=CN=C2)C(=O)O)C

InChI

InChI=1S/C16H13NO2S2/c1-9-3-10(2)5-11(4-9)20-14-7-17-8-15-12(14)6-13(21-15)16(18)19/h3-8H,1-2H3,(H,18,19)