3-[(3-acetamidophenyl)sulfanylmethyl]thiophene-2-carboxylate

Systemtic Name: 3-[(3-acetamidophenyl)sulfanylmethyl]thiophene-2-carboxylate Openeye Name: 3-[(3-acetamidophenyl)sulfanylmethyl]thiophene-2-carboxylate CAS Name: 3-[[(3-acetamidophenyl)thio]methyl]-2-thiophenecarboxylate IUPAC Name: 3-[(3-acetamidophenyl)sulfanylmethyl]thiophene-2-carboxylate Traditional Name: 3-[[(3-acetamidophenyl)thio]methyl]-2-thenoate Formula: C14H12NO3S2- MolecularWeight: 306.37998

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=CC=C1)SCC2=C(SC=C2)C(=O)[O-]

Isomeric SMILES

CC(=O)NC1=CC(=CC=C1)SCC2=C(SC=C2)C(=O)[O-]

InChI

InChI=1S/C14H13NO3S2/c1-9(16)15-11-3-2-4-12(7-11)20-8-10-5-6-19-13(10)14(17)18/h2-7H,8H2,1H3,(H,15,16)(H,17,18)/p-1