ethyl 2-[[1-(4-methoxyphenyl)sulfonylpiperidin-4-yl]carbonylamino]-1-benzothiophene-3-carboxylate

Systemtic Name: ethyl 2-[[1-(4-methoxyphenyl)sulfonylpiperidin-4-yl]carbonylamino]-1-benzothiophene-3-carboxylate Openeye Name: ethyl 2-[[1-(4-methoxyphenyl)sulfonylpiperidine-4-carbonyl]amino]benzothiophene-3-carboxylate CAS Name: 2-[[[1-(4-methoxyphenyl)sulfonyl-4-piperidinyl]-oxomethyl]amino]-1-benzothiophene-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-[[1-(4-methoxyphenyl)sulfonylpiperidine-4-carbonyl]amino]-1-benzothiophene-3-carboxylate Traditional Name: 2-[[1-(4-methoxyphenyl)sulfonylisonipecotoyl]amino]benzothiophene-3-carboxylic acid ethyl ester Formula: C24H26N2O6S2 MolecularWeight: 502.60304

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC2=CC=CC=C21)NC(=O)C3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)OC

Isomeric SMILES

CCOC(=O)C1=C(SC2=CC=CC=C21)NC(=O)C3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)OC

InChI

InChI=1S/C24H26N2O6S2/c1-3-32-24(28)21-19-6-4-5-7-20(19)33-23(21)25-22(27)16-12-14-26(15-13-16)34(29,30)18-10-8-17(31-2)9-11-18/h4-11,16H,3,12-15H2,1-2H3,(H,25,27)