ethyl 2-[[4-(methylsulfonylmethyl)phenyl]carbonylamino]-4-thiophen-2-yl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[[4-(methylsulfonylmethyl)phenyl]carbonylamino]-4-thiophen-2-yl-thiophene-3-carboxylate Openeye Name: ethyl 2-[[4-(methylsulfonylmethyl)benzoyl]amino]-4-(2-thienyl)thiophene-3-carboxylate CAS Name: 2-[[[4-(methylsulfonylmethyl)phenyl]-oxomethyl]amino]-4-thiophen-2-yl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[4-(methylsulfonylmethyl)benzoyl]amino]-4-thiophen-2-ylthiophene-3-carboxylate Traditional Name: 2-[[4-(mesylmethyl)benzoyl]amino]-4-(2-thienyl)thiophene-3-carboxylic acid ethyl ester Formula: C20H19NO5S3 MolecularWeight: 449.56356

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC=CS2)NC(=O)C3=CC=C(C=C3)CS(=O)(=O)C

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC=CS2)NC(=O)C3=CC=C(C=C3)CS(=O)(=O)C

InChI

InChI=1S/C20H19NO5S3/c1-3-26-20(23)17-15(16-5-4-10-27-16)11-28-19(17)21-18(22)14-8-6-13(7-9-14)12-29(2,24)25/h4-11H,3,12H2,1-2H3,(H,21,22)