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

Systemtic Name: 4-[3-[(4,5,6-trimethylpyrimidin-2-yl)sulfanylmethyl]phenyl]sulfonylmorpholine Openeye Name: 4-[3-[(4,5,6-trimethylpyrimidin-2-yl)sulfanylmethyl]phenyl]sulfonylmorpholine CAS Name: 4-[3-[[(4,5,6-trimethyl-2-pyrimidinyl)thio]methyl]phenyl]sulfonylmorpholine IUPAC Name: 4-[3-[(4,5,6-trimethylpyrimidin-2-yl)sulfanylmethyl]phenyl]sulfonylmorpholine Traditional Name: 4-[3-[[(4,5,6-trimethylpyrimidin-2-yl)thio]methyl]phenyl]sulfonylmorpholine Formula: C18H23N3O3S2 MolecularWeight: 393.52352

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H23N3O3S2/c1-13-14(2)19-18(20-15(13)3)25-12-16-5-4-6-17(11-16)26(22,23)21-7-9-24-10-8-21/h4-6,11H,7-10,12H2,1-3H3