methyl 2-[2-(phenylmethyl)sulfonylethanoylamino]thiophene-3-carboxylate

Systemtic Name: methyl 2-[2-(phenylmethyl)sulfonylethanoylamino]thiophene-3-carboxylate Openeye Name: methyl 2-[(2-benzylsulfonylacetyl)amino]thiophene-3-carboxylate CAS Name: 2-[[1-oxo-2-(phenylmethyl)sulfonylethyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[(2-benzylsulfonylacetyl)amino]thiophene-3-carboxylate Traditional Name: 2-[(2-benzylsulfonylacetyl)amino]thiophene-3-carboxylic acid methyl ester Formula: C15H15NO5S2 MolecularWeight: 353.4133

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(SC=C1)NC(=O)CS(=O)(=O)CC2=CC=CC=C2

Isomeric SMILES

COC(=O)C1=C(SC=C1)NC(=O)CS(=O)(=O)CC2=CC=CC=C2

InChI

InChI=1S/C15H15NO5S2/c1-21-15(18)12-7-8-22-14(12)16-13(17)10-23(19,20)9-11-5-3-2-4-6-11/h2-8H,9-10H2,1H3,(H,16,17)