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

Systemtic Name: ethyl 2-[[1-(4-cyanophenyl)sulfonylpiperidin-4-yl]carbonylamino]-4,5-dimethyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[[1-(4-cyanophenyl)sulfonylpiperidine-4-carbonyl]amino]-4,5-dimethyl-thiophene-3-carboxylate CAS Name: 2-[[[1-(4-cyanophenyl)sulfonyl-4-piperidinyl]-oxomethyl]amino]-4,5-dimethyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[1-(4-cyanophenyl)sulfonylpiperidine-4-carbonyl]amino]-4,5-dimethylthiophene-3-carboxylate Traditional Name: 2-[[1-(4-cyanophenyl)sulfonylisonipecotoyl]amino]-4,5-dimethyl-thiophene-3-carboxylic acid ethyl ester Formula: C22H25N3O5S2 MolecularWeight: 475.581

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C#N

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C22H25N3O5S2/c1-4-30-22(27)19-14(2)15(3)31-21(19)24-20(26)17-9-11-25(12-10-17)32(28,29)18-7-5-16(13-23)6-8-18/h5-8,17H,4,9-12H2,1-3H3,(H,24,26)