2-[(4-butoxyphenyl)sulfonylmethyl]-3-methylsulfanyl-N,2-bis(oxidanyl)-3-pyridin-2-yl-propanamide

Systemtic Name: 2-[(4-butoxyphenyl)sulfonylmethyl]-3-methylsulfanyl-N,2-bis(oxidanyl)-3-pyridin-2-yl-propanamide Openeye Name: 2-[(4-butoxyphenyl)sulfonylmethyl]-2-hydroxy-3-methylsulfanyl-3-(2-pyridyl)propanehydroxamic acid CAS Name: 2-[(4-butoxyphenyl)sulfonylmethyl]-N,2-dihydroxy-3-(methylthio)-3-(2-pyridinyl)propanamide IUPAC Name: 2-[(4-butoxyphenyl)sulfonylmethyl]-N,2-dihydroxy-3-methylsulfanyl-3-pyridin-2-ylpropanamide Traditional Name: 2-[(4-butoxyphenyl)sulfonylmethyl]-2-hydroxy-3-(methylthio)-3-(2-pyridyl)propanehydroxamic acid Formula: C20H26N2O6S2 MolecularWeight: 454.56024

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)S(=O)(=O)CC(C(C2=CC=CC=N2)SC)(C(=O)NO)O

Isomeric SMILES

CCCCOC1=CC=C(C=C1)S(=O)(=O)CC(C(C2=CC=CC=N2)SC)(C(=O)NO)O

InChI

InChI=1S/C20H26N2O6S2/c1-3-4-13-28-15-8-10-16(11-9-15)30(26,27)14-20(24,19(23)22-25)18(29-2)17-7-5-6-12-21-17/h5-12,18,24-25H,3-4,13-14H2,1-2H3,(H,22,23)