4-cyano-3-(2-fluorophenyl)sulfanyl-thiophene-2-sulfonic acid

Systemtic Name: 4-cyano-3-(2-fluorophenyl)sulfanyl-thiophene-2-sulfonic acid Openeye Name: 4-cyano-3-(2-fluorophenyl)sulfanyl-thiophene-2-sulfonic acid CAS Name: 4-cyano-3-[(2-fluorophenyl)thio]-2-thiophenesulfonic acid IUPAC Name: 4-cyano-3-(2-fluorophenyl)sulfanylthiophene-2-sulfonic acid Traditional Name: 4-cyano-3-[(2-fluorophenyl)thio]thiophene-2-sulfonic acid Formula: C11H6FNO3S3 MolecularWeight: 315.363643

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)F)SC2=C(SC=C2C#N)S(=O)(=O)O

Isomeric SMILES

C1=CC=C(C(=C1)F)SC2=C(SC=C2C#N)S(=O)(=O)O

InChI

InChI=1S/C11H6FNO3S3/c12-8-3-1-2-4-9(8)18-10-7(5-13)6-17-11(10)19(14,15)16/h1-4,6H,(H,14,15,16)