ethyl 5-ethyl-2-(3-methylsulfonylpropanoylamino)thiophene-3-carboxylate

Systemtic Name: ethyl 5-ethyl-2-(3-methylsulfonylpropanoylamino)thiophene-3-carboxylate Openeye Name: ethyl 5-ethyl-2-(3-methylsulfonylpropanoylamino)thiophene-3-carboxylate CAS Name: 5-ethyl-2-[(3-methylsulfonyl-1-oxopropyl)amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-ethyl-2-(3-methylsulfonylpropanoylamino)thiophene-3-carboxylate Traditional Name: 5-ethyl-2-(3-mesylpropanoylamino)thiophene-3-carboxylic acid ethyl ester Formula: C13H19NO5S2 MolecularWeight: 333.42366

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(S1)NC(=O)CCS(=O)(=O)C)C(=O)OCC

Isomeric SMILES

CCC1=CC(=C(S1)NC(=O)CCS(=O)(=O)C)C(=O)OCC

InChI

InChI=1S/C13H19NO5S2/c1-4-9-8-10(13(16)19-5-2)12(20-9)14-11(15)6-7-21(3,17)18/h8H,4-7H2,1-3H3,(H,14,15)