4-(4-cyclohexylsulfanylphenyl)sulfonyl-1-ethynyl-N-oxidanyl-piperidine-4-carboxamide

Systemtic Name: 4-(4-cyclohexylsulfanylphenyl)sulfonyl-1-ethynyl-N-oxidanyl-piperidine-4-carboxamide Openeye Name: 4-(4-cyclohexylsulfanylphenyl)sulfonyl-1-ethynyl-piperidine-4-carbohydroxamic acid CAS Name: 4-[4-(cyclohexylthio)phenyl]sulfonyl-1-ethynyl-N-hydroxy-4-piperidinecarboxamide IUPAC Name: 4-(4-cyclohexylsulfanylphenyl)sulfonyl-1-ethynyl-N-hydroxypiperidine-4-carboxamide Traditional Name: 4-[4-(cyclohexylthio)phenyl]sulfonyl-1-ethynyl-piperidine-4-carbohydroxamic acid Formula: C20H26N2O4S2 MolecularWeight: 422.56144

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Descriptors Computed from Structure

Canonical SMILES:

C#CN1CCC(CC1)(C(=O)NO)S(=O)(=O)C2=CC=C(C=C2)SC3CCCCC3

Isomeric SMILES

C#CN1CCC(CC1)(C(=O)NO)S(=O)(=O)C2=CC=C(C=C2)SC3CCCCC3

InChI

InChI=1S/C20H26N2O4S2/c1-2-22-14-12-20(13-15-22,19(23)21-24)28(25,26)18-10-8-17(9-11-18)27-16-6-4-3-5-7-16/h1,8-11,16,24H,3-7,12-15H2,(H,21,23)