ethyl 5-[[4-(methylsulfonylmethyl)phenyl]carbonylamino]-1-benzothiophene-2-carboxylate

Systemtic Name: ethyl 5-[[4-(methylsulfonylmethyl)phenyl]carbonylamino]-1-benzothiophene-2-carboxylate Openeye Name: ethyl 5-[[4-(methylsulfonylmethyl)benzoyl]amino]benzothiophene-2-carboxylate CAS Name: 5-[[[4-(methylsulfonylmethyl)phenyl]-oxomethyl]amino]-1-benzothiophene-2-carboxylic acid ethyl ester IUPAC Name: ethyl 5-[[4-(methylsulfonylmethyl)benzoyl]amino]-1-benzothiophene-2-carboxylate Traditional Name: 5-[[4-(mesylmethyl)benzoyl]amino]benzothiophene-2-carboxylic acid ethyl ester Formula: C20H19NO5S2 MolecularWeight: 417.49856

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(S1)C=CC(=C2)NC(=O)C3=CC=C(C=C3)CS(=O)(=O)C

Isomeric SMILES

CCOC(=O)C1=CC2=C(S1)C=CC(=C2)NC(=O)C3=CC=C(C=C3)CS(=O)(=O)C

InChI

InChI=1S/C20H19NO5S2/c1-3-26-20(23)18-11-15-10-16(8-9-17(15)27-18)21-19(22)14-6-4-13(5-7-14)12-28(2,24)25/h4-11H,3,12H2,1-2H3,(H,21,22)