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

Systemtic Name: ethyl 5-[(4-methylsulfonylphenyl)carbonylamino]-1-benzothiophene-2-carboxylate Openeye Name: ethyl 5-[(4-methylsulfonylbenzoyl)amino]benzothiophene-2-carboxylate CAS Name: 5-[[(4-methylsulfonylphenyl)-oxomethyl]amino]-1-benzothiophene-2-carboxylic acid ethyl ester IUPAC Name: ethyl 5-[(4-methylsulfonylbenzoyl)amino]-1-benzothiophene-2-carboxylate Traditional Name: 5-[(4-mesylbenzoyl)amino]benzothiophene-2-carboxylic acid ethyl ester Formula: C19H17NO5S2 MolecularWeight: 403.47198

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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)S(=O)(=O)C

Isomeric SMILES

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

InChI

InChI=1S/C19H17NO5S2/c1-3-25-19(22)17-11-13-10-14(6-9-16(13)26-17)20-18(21)12-4-7-15(8-5-12)27(2,23)24/h4-11H,3H2,1-2H3,(H,20,21)