methyl 3-[(4-ethylsulfonylphenyl)carbonylamino]-1-benzothiophene-2-carboxylate

Systemtic Name: methyl 3-[(4-ethylsulfonylphenyl)carbonylamino]-1-benzothiophene-2-carboxylate Openeye Name: methyl 3-[(4-ethylsulfonylbenzoyl)amino]benzothiophene-2-carboxylate CAS Name: 3-[[(4-ethylsulfonylphenyl)-oxomethyl]amino]-1-benzothiophene-2-carboxylic acid methyl ester IUPAC Name: methyl 3-[(4-ethylsulfonylbenzoyl)amino]-1-benzothiophene-2-carboxylate Traditional Name: 3-[(4-esylbenzoyl)amino]benzothiophene-2-carboxylic acid methyl ester Formula: C19H17NO5S2 MolecularWeight: 403.47198

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=CC=C(C=C1)C(=O)NC2=C(SC3=CC=CC=C32)C(=O)OC

Isomeric SMILES

CCS(=O)(=O)C1=CC=C(C=C1)C(=O)NC2=C(SC3=CC=CC=C32)C(=O)OC

InChI

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