methyl 2-azanyl-4-(4-methylsulfonylphenyl)thiophene-3-carboxylate

Systemtic Name: methyl 2-azanyl-4-(4-methylsulfonylphenyl)thiophene-3-carboxylate Openeye Name: methyl 2-amino-4-(4-methylsulfonylphenyl)thiophene-3-carboxylate CAS Name: 2-amino-4-(4-methylsulfonylphenyl)-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-amino-4-(4-methylsulfonylphenyl)thiophene-3-carboxylate Traditional Name: 2-amino-4-(4-mesylphenyl)thiophene-3-carboxylic acid methyl ester Formula: C13H13NO4S2 MolecularWeight: 311.37662

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(SC=C1C2=CC=C(C=C2)S(=O)(=O)C)N

Isomeric SMILES

COC(=O)C1=C(SC=C1C2=CC=C(C=C2)S(=O)(=O)C)N

InChI

InChI=1S/C13H13NO4S2/c1-18-13(15)11-10(7-19-12(11)14)8-3-5-9(6-4-8)20(2,16)17/h3-7H,14H2,1-2H3