sodium 2-[5-[2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)ethoxy]pentylsulfanyl]ethanoate

Systemtic Name: sodium 2-[5-[2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)ethoxy]pentylsulfanyl]ethanoate Openeye Name: sodium 2-[5-[2-(5-methyl-2-phenyl-oxazol-4-yl)ethoxy]pentylsulfanyl]acetate CAS Name: sodium 2-[5-[2-(5-methyl-2-phenyl-4-oxazolyl)ethoxy]pentylthio]acetate IUPAC Name: sodium 2-[5-[2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)ethoxy]pentylsulfanyl]acetate Traditional Name: sodium 2-[5-[2-(5-methyl-2-phenyl-oxazol-4-yl)ethoxy]pentylthio]acetate Formula: C19H24NNaO4S MolecularWeight: 385.45293

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(O1)C2=CC=CC=C2)CCOCCCCCSCC(=O)[O-].[Na+]

Isomeric SMILES

CC1=C(N=C(O1)C2=CC=CC=C2)CCOCCCCCSCC(=O)[O-].[Na+]

InChI

InChI=1S/C19H25NO4S.Na/c1-15-17(20-19(24-15)16-8-4-2-5-9-16)10-12-23-11-6-3-7-13-25-14-18(21)22;/h2,4-5,8-9H,3,6-7,10-14H2,1H3,(H,21,22);/q;+1/p-1