ethyl 2-[[1-(3-ethanoylphenyl)sulfonylpiperidin-4-yl]carbonylamino]-5-ethyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[[1-(3-ethanoylphenyl)sulfonylpiperidin-4-yl]carbonylamino]-5-ethyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[[1-(3-acetylphenyl)sulfonylpiperidine-4-carbonyl]amino]-5-ethyl-thiophene-3-carboxylate CAS Name: 2-[[[1-(3-acetylphenyl)sulfonyl-4-piperidinyl]-oxomethyl]amino]-5-ethyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[1-(3-acetylphenyl)sulfonylpiperidine-4-carbonyl]amino]-5-ethylthiophene-3-carboxylate Traditional Name: 2-[[1-(3-acetylphenyl)sulfonylisonipecotoyl]amino]-5-ethyl-thiophene-3-carboxylic acid ethyl ester Formula: C23H28N2O6S2 MolecularWeight: 492.60822

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(S1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC(=C3)C(=O)C)C(=O)OCC

Isomeric SMILES

CCC1=CC(=C(S1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC(=C3)C(=O)C)C(=O)OCC

InChI

InChI=1S/C23H28N2O6S2/c1-4-18-14-20(23(28)31-5-2)22(32-18)24-21(27)16-9-11-25(12-10-16)33(29,30)19-8-6-7-17(13-19)15(3)26/h6-8,13-14,16H,4-5,9-12H2,1-3H3,(H,24,27)