ethyl 3-[2-(3-methylsulfonylphenyl)carbonyloxyethanoylamino]-5-phenyl-thiophene-2-carboxylate

Systemtic Name: ethyl 3-[2-(3-methylsulfonylphenyl)carbonyloxyethanoylamino]-5-phenyl-thiophene-2-carboxylate Openeye Name: ethyl 3-[[2-(3-methylsulfonylbenzoyl)oxyacetyl]amino]-5-phenyl-thiophene-2-carboxylate CAS Name: 3-[[2-[(3-methylsulfonylphenyl)-oxomethoxy]-1-oxoethyl]amino]-5-phenyl-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[[2-(3-methylsulfonylbenzoyl)oxyacetyl]amino]-5-phenylthiophene-2-carboxylate Traditional Name: 3-[[2-(3-mesylbenzoyl)oxyacetyl]amino]-5-phenyl-thiophene-2-carboxylic acid ethyl ester Formula: C23H21NO7S2 MolecularWeight: 487.54534

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=C(S1)C2=CC=CC=C2)NC(=O)COC(=O)C3=CC(=CC=C3)S(=O)(=O)C

Isomeric SMILES

CCOC(=O)C1=C(C=C(S1)C2=CC=CC=C2)NC(=O)COC(=O)C3=CC(=CC=C3)S(=O)(=O)C

InChI

InChI=1S/C23H21NO7S2/c1-3-30-23(27)21-18(13-19(32-21)15-8-5-4-6-9-15)24-20(25)14-31-22(26)16-10-7-11-17(12-16)33(2,28)29/h4-13H,3,14H2,1-2H3,(H,24,25)