5-[2-(1-benzothiophen-5-ylmethylsulfonyl)ethyl]thiophene-2-carboxylic acid

Systemtic Name: 5-[2-(1-benzothiophen-5-ylmethylsulfonyl)ethyl]thiophene-2-carboxylic acid Openeye Name: 5-[2-(benzothiophen-5-ylmethylsulfonyl)ethyl]thiophene-2-carboxylic acid CAS Name: 5-[2-(1-benzothiophen-5-ylmethylsulfonyl)ethyl]-2-thiophenecarboxylic acid IUPAC Name: 5-[2-(1-benzothiophen-5-ylmethylsulfonyl)ethyl]thiophene-2-carboxylic acid Traditional Name: 5-[2-(benzothiophen-5-ylmethylsulfonyl)ethyl]-2-thenoic acid Formula: C16H14O4S3 MolecularWeight: 366.47496

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CS2)C=C1CS(=O)(=O)CCC3=CC=C(S3)C(=O)O

Isomeric SMILES

C1=CC2=C(C=CS2)C=C1CS(=O)(=O)CCC3=CC=C(S3)C(=O)O

InChI

InChI=1S/C16H14O4S3/c17-16(18)15-4-2-13(22-15)6-8-23(19,20)10-11-1-3-14-12(9-11)5-7-21-14/h1-5,7,9H,6,8,10H2,(H,17,18)