methyl 3-[(3-methylsulfonylphenyl)carbonylamino]thiophene-2-carboxylate

Systemtic Name: methyl 3-[(3-methylsulfonylphenyl)carbonylamino]thiophene-2-carboxylate Openeye Name: methyl 3-[(3-methylsulfonylbenzoyl)amino]thiophene-2-carboxylate CAS Name: 3-[[(3-methylsulfonylphenyl)-oxomethyl]amino]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-[(3-methylsulfonylbenzoyl)amino]thiophene-2-carboxylate Traditional Name: 3-[(3-mesylbenzoyl)amino]thiophene-2-carboxylic acid methyl ester Formula: C14H13NO5S2 MolecularWeight: 339.38672

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CS1)NC(=O)C2=CC(=CC=C2)S(=O)(=O)C

Isomeric SMILES

COC(=O)C1=C(C=CS1)NC(=O)C2=CC(=CC=C2)S(=O)(=O)C

InChI

InChI=1S/C14H13NO5S2/c1-20-14(17)12-11(6-7-21-12)15-13(16)9-4-3-5-10(8-9)22(2,18)19/h3-8H,1-2H3,(H,15,16)