N-oxidanyl-4-(4-phenylsulfanylphenyl)sulfonyl-1-prop-2-ynyl-piperidine-4-carboxamide

Systemtic Name: N-oxidanyl-4-(4-phenylsulfanylphenyl)sulfonyl-1-prop-2-ynyl-piperidine-4-carboxamide Openeye Name: 4-(4-phenylsulfanylphenyl)sulfonyl-1-prop-2-ynyl-piperidine-4-carbohydroxamic acid CAS Name: N-hydroxy-4-[4-(phenylthio)phenyl]sulfonyl-1-prop-2-ynyl-4-piperidinecarboxamide IUPAC Name: N-hydroxy-4-(4-phenylsulfanylphenyl)sulfonyl-1-prop-2-ynylpiperidine-4-carboxamide Traditional Name: 4-[4-(phenylthio)phenyl]sulfonyl-1-propargyl-piperidine-4-carbohydroxamic acid Formula: C21H22N2O4S2 MolecularWeight: 430.54038

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Descriptors Computed from Structure

Canonical SMILES:

C#CCN1CCC(CC1)(C(=O)NO)S(=O)(=O)C2=CC=C(C=C2)SC3=CC=CC=C3

Isomeric SMILES

C#CCN1CCC(CC1)(C(=O)NO)S(=O)(=O)C2=CC=C(C=C2)SC3=CC=CC=C3

InChI

InChI=1S/C21H22N2O4S2/c1-2-14-23-15-12-21(13-16-23,20(24)22-25)29(26,27)19-10-8-18(9-11-19)28-17-6-4-3-5-7-17/h1,3-11,25H,12-16H2,(H,22,24)