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

Systemtic Name: ethyl 2-[(3-methylsulfonylphenyl)carbonylamino]-4-thiophen-2-yl-thiophene-3-carboxylate Openeye Name: ethyl 2-[(3-methylsulfonylbenzoyl)amino]-4-(2-thienyl)thiophene-3-carboxylate CAS Name: 2-[[(3-methylsulfonylphenyl)-oxomethyl]amino]-4-thiophen-2-yl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(3-methylsulfonylbenzoyl)amino]-4-thiophen-2-ylthiophene-3-carboxylate Traditional Name: 2-[(3-mesylbenzoyl)amino]-4-(2-thienyl)thiophene-3-carboxylic acid ethyl ester Formula: C19H17NO5S3 MolecularWeight: 435.53698

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H17NO5S3/c1-3-25-19(22)16-14(15-8-5-9-26-15)11-27-18(16)20-17(21)12-6-4-7-13(10-12)28(2,23)24/h4-11H,3H2,1-2H3,(H,20,21)