[2-(cyclohexylmethylamino)-2-oxidanylidene-ethyl] 3-piperidin-1-ylsulfonylthiophene-2-carboxylate

Systemtic Name: [2-(cyclohexylmethylamino)-2-oxidanylidene-ethyl] 3-piperidin-1-ylsulfonylthiophene-2-carboxylate Openeye Name: [2-(cyclohexylmethylamino)-2-oxo-ethyl] 3-(1-piperidylsulfonyl)thiophene-2-carboxylate CAS Name: 3-(1-piperidinylsulfonyl)-2-thiophenecarboxylic acid [2-(cyclohexylmethylamino)-2-oxoethyl] ester IUPAC Name: [2-(cyclohexylmethylamino)-2-oxoethyl] 3-piperidin-1-ylsulfonylthiophene-2-carboxylate Traditional Name: 3-piperidinosulfonylthiophene-2-carboxylic acid [2-(cyclohexylmethylamino)-2-keto-ethyl] ester Formula: C19H28N2O5S2 MolecularWeight: 428.56602

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CNC(=O)COC(=O)C2=C(C=CS2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

C1CCC(CC1)CNC(=O)COC(=O)C2=C(C=CS2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C19H28N2O5S2/c22-17(20-13-15-7-3-1-4-8-15)14-26-19(23)18-16(9-12-27-18)28(24,25)21-10-5-2-6-11-21/h9,12,15H,1-8,10-11,13-14H2,(H,20,22)