N,2-bis(oxidanyl)-2-[(phenylmethylsulfanyl)methyl]-3-(4-pyridin-4-yloxyphenyl)sulfonyl-propanamide

Systemtic Name: N,2-bis(oxidanyl)-2-[(phenylmethylsulfanyl)methyl]-3-(4-pyridin-4-yloxyphenyl)sulfonyl-propanamide Openeye Name: 2-(benzylsulfanylmethyl)-2-hydroxy-3-[4-(4-pyridyloxy)phenyl]sulfonyl-propanehydroxamic acid CAS Name: N,2-dihydroxy-2-[(phenylmethylthio)methyl]-3-(4-pyridin-4-yloxyphenyl)sulfonylpropanamide IUPAC Name: 2-(benzylsulfanylmethyl)-N,2-dihydroxy-3-(4-pyridin-4-yloxyphenyl)sulfonylpropanamide Traditional Name: 2-[(benzylthio)methyl]-2-hydroxy-3-[4-(4-pyridyloxy)phenyl]sulfonyl-propanehydroxamic acid Formula: C22H22N2O6S2 MolecularWeight: 474.54988

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSCC(CS(=O)(=O)C2=CC=C(C=C2)OC3=CC=NC=C3)(C(=O)NO)O

Isomeric SMILES

C1=CC=C(C=C1)CSCC(CS(=O)(=O)C2=CC=C(C=C2)OC3=CC=NC=C3)(C(=O)NO)O

InChI

InChI=1S/C22H22N2O6S2/c25-21(24-27)22(26,15-31-14-17-4-2-1-3-5-17)16-32(28,29)20-8-6-18(7-9-20)30-19-10-12-23-13-11-19/h1-13,26-27H,14-16H2,(H,24,25)