4-(4-cyclohexylsulfanylphenyl)sulfonyl-N-oxidanyl-N-prop-2-ynyl-piperidine-4-carboxamide

Systemtic Name: 4-(4-cyclohexylsulfanylphenyl)sulfonyl-N-oxidanyl-N-prop-2-ynyl-piperidine-4-carboxamide Openeye Name: 4-(4-cyclohexylsulfanylphenyl)sulfonyl-N-hydroxy-N-prop-2-ynyl-piperidine-4-carboxamide CAS Name: 4-[4-(cyclohexylthio)phenyl]sulfonyl-N-hydroxy-N-prop-2-ynyl-4-piperidinecarboxamide IUPAC Name: 4-(4-cyclohexylsulfanylphenyl)sulfonyl-N-hydroxy-N-prop-2-ynylpiperidine-4-carboxamide Traditional Name: 4-[4-(cyclohexylthio)phenyl]sulfonyl-N-hydroxy-N-propargyl-isonipecotamide Formula: C21H28N2O4S2 MolecularWeight: 436.58802

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Descriptors Computed from Structure

Canonical SMILES:

C#CCN(C(=O)C1(CCNCC1)S(=O)(=O)C2=CC=C(C=C2)SC3CCCCC3)O

Isomeric SMILES

C#CCN(C(=O)C1(CCNCC1)S(=O)(=O)C2=CC=C(C=C2)SC3CCCCC3)O

InChI

InChI=1S/C21H28N2O4S2/c1-2-16-23(25)20(24)21(12-14-22-15-13-21)29(26,27)19-10-8-18(9-11-19)28-17-6-4-3-5-7-17/h1,8-11,17,22,25H,3-7,12-16H2