methyl 3-azanyl-4-(4-methylphenyl)sulfonyl-thiophene-2-carboxylate

Systemtic Name: methyl 3-azanyl-4-(4-methylphenyl)sulfonyl-thiophene-2-carboxylate Openeye Name: methyl 3-amino-4-(p-tolylsulfonyl)thiophene-2-carboxylate CAS Name: 3-amino-4-(4-methylphenyl)sulfonyl-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-amino-4-(4-methylphenyl)sulfonylthiophene-2-carboxylate Traditional Name: 3-amino-4-tosyl-thiophene-2-carboxylic acid methyl ester Formula: C13H13NO4S2 MolecularWeight: 311.37662

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C2=CSC(=C2N)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C2=CSC(=C2N)C(=O)OC

InChI

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