4-[3-[(2,6-dimethylpyrimidin-4-yl)sulfanylmethyl]phenyl]sulfonylmorpholine

Systemtic Name: 4-[3-[(2,6-dimethylpyrimidin-4-yl)sulfanylmethyl]phenyl]sulfonylmorpholine Openeye Name: 4-[3-[(2,6-dimethylpyrimidin-4-yl)sulfanylmethyl]phenyl]sulfonylmorpholine CAS Name: 4-[3-[[(2,6-dimethyl-4-pyrimidinyl)thio]methyl]phenyl]sulfonylmorpholine IUPAC Name: 4-[3-[(2,6-dimethylpyrimidin-4-yl)sulfanylmethyl]phenyl]sulfonylmorpholine Traditional Name: 4-[3-[[(2,6-dimethylpyrimidin-4-yl)thio]methyl]phenyl]sulfonylmorpholine Formula: C17H21N3O3S2 MolecularWeight: 379.49694

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H21N3O3S2/c1-13-10-17(19-14(2)18-13)24-12-15-4-3-5-16(11-15)25(21,22)20-6-8-23-9-7-20/h3-5,10-11H,6-9,12H2,1-2H3