[2-[(3-methylsulfonylphenyl)amino]-2-oxidanylidene-ethyl] 4-ethyl-5-propyl-thiophene-2-carboxylate

Systemtic Name: [2-[(3-methylsulfonylphenyl)amino]-2-oxidanylidene-ethyl] 4-ethyl-5-propyl-thiophene-2-carboxylate Openeye Name: [2-(3-methylsulfonylanilino)-2-oxo-ethyl] 4-ethyl-5-propyl-thiophene-2-carboxylate CAS Name: 4-ethyl-5-propyl-2-thiophenecarboxylic acid [2-(3-methylsulfonylanilino)-2-oxoethyl] ester IUPAC Name: [2-(3-methylsulfonylanilino)-2-oxoethyl] 4-ethyl-5-propylthiophene-2-carboxylate Traditional Name: 4-ethyl-5-propyl-thiophene-2-carboxylic acid [2-keto-2-(3-mesylanilino)ethyl] ester Formula: C19H23NO5S2 MolecularWeight: 409.51962

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=C(S1)C(=O)OCC(=O)NC2=CC(=CC=C2)S(=O)(=O)C)CC

Isomeric SMILES

CCCC1=C(C=C(S1)C(=O)OCC(=O)NC2=CC(=CC=C2)S(=O)(=O)C)CC

InChI

InChI=1S/C19H23NO5S2/c1-4-7-16-13(5-2)10-17(26-16)19(22)25-12-18(21)20-14-8-6-9-15(11-14)27(3,23)24/h6,8-11H,4-5,7,12H2,1-3H3,(H,20,21)