4-[3-[(2,3,5,6-tetramethylphenyl)sulfanylmethyl]phenyl]sulfonylmorpholine

Systemtic Name: 4-[3-[(2,3,5,6-tetramethylphenyl)sulfanylmethyl]phenyl]sulfonylmorpholine Openeye Name: 4-[3-[(2,3,5,6-tetramethylphenyl)sulfanylmethyl]phenyl]sulfonylmorpholine CAS Name: 4-[3-[[(2,3,5,6-tetramethylphenyl)thio]methyl]phenyl]sulfonylmorpholine IUPAC Name: 4-[3-[(2,3,5,6-tetramethylphenyl)sulfanylmethyl]phenyl]sulfonylmorpholine Traditional Name: 4-[3-[[(2,3,5,6-tetramethylphenyl)thio]methyl]phenyl]sulfonylmorpholine Formula: C21H27NO3S2 MolecularWeight: 405.57398

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1C)SCC2=CC(=CC=C2)S(=O)(=O)N3CCOCC3)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1C)SCC2=CC(=CC=C2)S(=O)(=O)N3CCOCC3)C)C

InChI

InChI=1S/C21H27NO3S2/c1-15-12-16(2)18(4)21(17(15)3)26-14-19-6-5-7-20(13-19)27(23,24)22-8-10-25-11-9-22/h5-7,12-13H,8-11,14H2,1-4H3