ethyl 3-azanyl-5-methylsulfanyl-4-methylsulfonyl-thiophene-2-carboxylate

Systemtic Name: ethyl 3-azanyl-5-methylsulfanyl-4-methylsulfonyl-thiophene-2-carboxylate Openeye Name: ethyl 3-amino-5-methylsulfanyl-4-methylsulfonyl-thiophene-2-carboxylate CAS Name: 3-amino-4-methylsulfonyl-5-(methylthio)-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 3-amino-5-methylsulfanyl-4-methylsulfonylthiophene-2-carboxylate Traditional Name: 3-amino-4-mesyl-5-(methylthio)thiophene-2-carboxylic acid ethyl ester Formula: C9H13NO4S3 MolecularWeight: 295.39882

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(S1)SC)S(=O)(=O)C)N

Isomeric SMILES

CCOC(=O)C1=C(C(=C(S1)SC)S(=O)(=O)C)N

InChI

InChI=1S/C9H13NO4S3/c1-4-14-8(11)6-5(10)7(17(3,12)13)9(15-2)16-6/h4,10H2,1-3H3