4-[3-[2-(3,5-dimethylphenoxy)ethylsulfanylmethyl]phenyl]sulfonylmorpholine

Systemtic Name: 4-[3-[2-(3,5-dimethylphenoxy)ethylsulfanylmethyl]phenyl]sulfonylmorpholine Openeye Name: 4-[3-[2-(3,5-dimethylphenoxy)ethylsulfanylmethyl]phenyl]sulfonylmorpholine CAS Name: 4-[3-[[2-(3,5-dimethylphenoxy)ethylthio]methyl]phenyl]sulfonylmorpholine IUPAC Name: 4-[3-[2-(3,5-dimethylphenoxy)ethylsulfanylmethyl]phenyl]sulfonylmorpholine Traditional Name: 4-[3-[[2-(3,5-dimethylphenoxy)ethylthio]methyl]phenyl]sulfonylmorpholine Formula: C21H27NO4S2 MolecularWeight: 421.57338

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OCCSCC2=CC(=CC=C2)S(=O)(=O)N3CCOCC3)C

Isomeric SMILES

CC1=CC(=CC(=C1)OCCSCC2=CC(=CC=C2)S(=O)(=O)N3CCOCC3)C

InChI

InChI=1S/C21H27NO4S2/c1-17-12-18(2)14-20(13-17)26-10-11-27-16-19-4-3-5-21(15-19)28(23,24)22-6-8-25-9-7-22/h3-5,12-15H,6-11,16H2,1-2H3