methyl 3-acetamido-4-cyano-5-methylsulfanyl-thiophene-2-carboxylate

Systemtic Name: methyl 3-acetamido-4-cyano-5-methylsulfanyl-thiophene-2-carboxylate Openeye Name: methyl 3-acetamido-4-cyano-5-methylsulfanyl-thiophene-2-carboxylate CAS Name: 3-acetamido-4-cyano-5-(methylthio)-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-acetamido-4-cyano-5-methylsulfanylthiophene-2-carboxylate Traditional Name: 3-acetamido-4-cyano-5-(methylthio)thiophene-2-carboxylic acid methyl ester Formula: C10H10N2O3S2 MolecularWeight: 270.328

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(SC(=C1C#N)SC)C(=O)OC

Isomeric SMILES

CC(=O)NC1=C(SC(=C1C#N)SC)C(=O)OC

InChI

InChI=1S/C10H10N2O3S2/c1-5(13)12-7-6(4-11)10(16-3)17-8(7)9(14)15-2/h1-3H3,(H,12,13)