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

Systemtic Name: methyl 3-[(4-methylsulfonylphenyl)carbonylamino]-1-benzothiophene-2-carboxylate Openeye Name: methyl 3-[(4-methylsulfonylbenzoyl)amino]benzothiophene-2-carboxylate CAS Name: 3-[[(4-methylsulfonylphenyl)-oxomethyl]amino]-1-benzothiophene-2-carboxylic acid methyl ester IUPAC Name: methyl 3-[(4-methylsulfonylbenzoyl)amino]-1-benzothiophene-2-carboxylate Traditional Name: 3-[(4-mesylbenzoyl)amino]benzothiophene-2-carboxylic acid methyl ester Formula: C18H15NO5S2 MolecularWeight: 389.4454

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C2=CC=CC=C2S1)NC(=O)C3=CC=C(C=C3)S(=O)(=O)C

Isomeric SMILES

COC(=O)C1=C(C2=CC=CC=C2S1)NC(=O)C3=CC=C(C=C3)S(=O)(=O)C

InChI

InChI=1S/C18H15NO5S2/c1-24-18(21)16-15(13-5-3-4-6-14(13)25-16)19-17(20)11-7-9-12(10-8-11)26(2,22)23/h3-10H,1-2H3,(H,19,20)