4-(4-methylphenyl)sulfanyl-1-benzothiophene-2-carboxylic acid

Systemtic Name: 4-(4-methylphenyl)sulfanyl-1-benzothiophene-2-carboxylic acid Openeye Name: 4-(p-tolylsulfanyl)benzothiophene-2-carboxylic acid CAS Name: 4-[(4-methylphenyl)thio]-1-benzothiophene-2-carboxylic acid IUPAC Name: 4-(4-methylphenyl)sulfanyl-1-benzothiophene-2-carboxylic acid Traditional Name: 4-(p-tolylthio)benzothiophene-2-carboxylic acid Formula: C16H12O2S2 MolecularWeight: 300.39528

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC2=CC=CC3=C2C=C(S3)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)SC2=CC=CC3=C2C=C(S3)C(=O)O

InChI

InChI=1S/C16H12O2S2/c1-10-5-7-11(8-6-10)19-13-3-2-4-14-12(13)9-15(20-14)16(17)18/h2-9H,1H3,(H,17,18)