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

Systemtic Name: ethyl 2-[[1-(2-cyanophenyl)sulfonylpiperidin-4-yl]carbonylamino]-4-cyclopropyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[[1-(2-cyanophenyl)sulfonylpiperidine-4-carbonyl]amino]-4-cyclopropyl-thiophene-3-carboxylate CAS Name: 2-[[[1-(2-cyanophenyl)sulfonyl-4-piperidinyl]-oxomethyl]amino]-4-cyclopropyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[1-(2-cyanophenyl)sulfonylpiperidine-4-carbonyl]amino]-4-cyclopropylthiophene-3-carboxylate Traditional Name: 2-[[1-(2-cyanophenyl)sulfonylisonipecotoyl]amino]-4-cyclopropyl-thiophene-3-carboxylic acid ethyl ester Formula: C23H25N3O5S2 MolecularWeight: 487.5917

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2CC2)NC(=O)C3CCN(CC3)S(=O)(=O)C4=CC=CC=C4C#N

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2CC2)NC(=O)C3CCN(CC3)S(=O)(=O)C4=CC=CC=C4C#N

InChI

InChI=1S/C23H25N3O5S2/c1-2-31-23(28)20-18(15-7-8-15)14-32-22(20)25-21(27)16-9-11-26(12-10-16)33(29,30)19-6-4-3-5-17(19)13-24/h3-6,14-16H,2,7-12H2,1H3,(H,25,27)