ethyl 5-ethyl-2-[[5-(phenylsulfonylmethyl)furan-2-yl]carbonylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 5-ethyl-2-[[5-(phenylsulfonylmethyl)furan-2-yl]carbonylamino]thiophene-3-carboxylate Openeye Name: ethyl 2-[[5-(benzenesulfonylmethyl)furan-2-carbonyl]amino]-5-ethyl-thiophene-3-carboxylate CAS Name: 2-[[[5-(benzenesulfonylmethyl)-2-furanyl]-oxomethyl]amino]-5-ethyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[5-(benzenesulfonylmethyl)furan-2-carbonyl]amino]-5-ethylthiophene-3-carboxylate Traditional Name: 2-[[5-(besylmethyl)-2-furoyl]amino]-5-ethyl-thiophene-3-carboxylic acid ethyl ester Formula: C21H21NO6S2 MolecularWeight: 447.52454

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(S1)NC(=O)C2=CC=C(O2)CS(=O)(=O)C3=CC=CC=C3)C(=O)OCC

Isomeric SMILES

CCC1=CC(=C(S1)NC(=O)C2=CC=C(O2)CS(=O)(=O)C3=CC=CC=C3)C(=O)OCC

InChI

InChI=1S/C21H21NO6S2/c1-3-15-12-17(21(24)27-4-2)20(29-15)22-19(23)18-11-10-14(28-18)13-30(25,26)16-8-6-5-7-9-16/h5-12H,3-4,13H2,1-2H3,(H,22,23)