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

Systemtic Name: 4-[3-[(1-cyclohexyl-4,5-dimethyl-imidazol-2-yl)sulfanylmethyl]phenyl]sulfonylmorpholine Openeye Name: 4-[3-[(1-cyclohexyl-4,5-dimethyl-imidazol-2-yl)sulfanylmethyl]phenyl]sulfonylmorpholine CAS Name: 4-[3-[[(1-cyclohexyl-4,5-dimethyl-2-imidazolyl)thio]methyl]phenyl]sulfonylmorpholine IUPAC Name: 4-[3-[(1-cyclohexyl-4,5-dimethylimidazol-2-yl)sulfanylmethyl]phenyl]sulfonylmorpholine Traditional Name: 4-[3-[[(1-cyclohexyl-4,5-dimethyl-imidazol-2-yl)thio]methyl]phenyl]sulfonylmorpholine Formula: C22H31N3O3S2 MolecularWeight: 449.62984

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C(=N1)SCC2=CC(=CC=C2)S(=O)(=O)N3CCOCC3)C4CCCCC4)C

Isomeric SMILES

CC1=C(N(C(=N1)SCC2=CC(=CC=C2)S(=O)(=O)N3CCOCC3)C4CCCCC4)C

InChI

InChI=1S/C22H31N3O3S2/c1-17-18(2)25(20-8-4-3-5-9-20)22(23-17)29-16-19-7-6-10-21(15-19)30(26,27)24-11-13-28-14-12-24/h6-7,10,15,20H,3-5,8-9,11-14,16H2,1-2H3