4-[3-[[1-(3,5-dimethylphenyl)imidazol-2-yl]sulfanylmethyl]phenyl]sulfonylmorpholine

Systemtic Name: 4-[3-[[1-(3,5-dimethylphenyl)imidazol-2-yl]sulfanylmethyl]phenyl]sulfonylmorpholine Openeye Name: 4-[3-[[1-(3,5-dimethylphenyl)imidazol-2-yl]sulfanylmethyl]phenyl]sulfonylmorpholine CAS Name: 4-[3-[[[1-(3,5-dimethylphenyl)-2-imidazolyl]thio]methyl]phenyl]sulfonylmorpholine IUPAC Name: 4-[3-[[1-(3,5-dimethylphenyl)imidazol-2-yl]sulfanylmethyl]phenyl]sulfonylmorpholine Traditional Name: 4-[3-[[[1-(3,5-dimethylphenyl)imidazol-2-yl]thio]methyl]phenyl]sulfonylmorpholine Formula: C22H25N3O3S2 MolecularWeight: 443.5822

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)N2C=CN=C2SCC3=CC(=CC=C3)S(=O)(=O)N4CCOCC4)C

Isomeric SMILES

CC1=CC(=CC(=C1)N2C=CN=C2SCC3=CC(=CC=C3)S(=O)(=O)N4CCOCC4)C

InChI

InChI=1S/C22H25N3O3S2/c1-17-12-18(2)14-20(13-17)25-7-6-23-22(25)29-16-19-4-3-5-21(15-19)30(26,27)24-8-10-28-11-9-24/h3-7,12-15H,8-11,16H2,1-2H3