methyl 5-[(1-methylsulfonylpiperidin-4-yl)carbonylamino]-1-benzothiophene-2-carboxylate

Systemtic Name: methyl 5-[(1-methylsulfonylpiperidin-4-yl)carbonylamino]-1-benzothiophene-2-carboxylate Openeye Name: methyl 5-[(1-methylsulfonylpiperidine-4-carbonyl)amino]benzothiophene-2-carboxylate CAS Name: 5-[[(1-methylsulfonyl-4-piperidinyl)-oxomethyl]amino]-1-benzothiophene-2-carboxylic acid methyl ester IUPAC Name: methyl 5-[(1-methylsulfonylpiperidine-4-carbonyl)amino]-1-benzothiophene-2-carboxylate Traditional Name: 5-[(1-mesylisonipecotoyl)amino]benzothiophene-2-carboxylic acid methyl ester Formula: C17H20N2O5S2 MolecularWeight: 396.4811

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(S1)C=CC(=C2)NC(=O)C3CCN(CC3)S(=O)(=O)C

Isomeric SMILES

COC(=O)C1=CC2=C(S1)C=CC(=C2)NC(=O)C3CCN(CC3)S(=O)(=O)C

InChI

InChI=1S/C17H20N2O5S2/c1-24-17(21)15-10-12-9-13(3-4-14(12)25-15)18-16(20)11-5-7-19(8-6-11)26(2,22)23/h3-4,9-11H,5-8H2,1-2H3,(H,18,20)