1-[(3S,5S)-3,5-dimethylmorpholin-4-yl]-2-(6-methylpyrimidin-4-yl)sulfanyl-ethanone

Systemtic Name: 1-[(3S,5S)-3,5-dimethylmorpholin-4-yl]-2-(6-methylpyrimidin-4-yl)sulfanyl-ethanone Openeye Name: 1-[(3S,5S)-3,5-dimethylmorpholin-4-yl]-2-(6-methylpyrimidin-4-yl)sulfanyl-ethanone CAS Name: 1-[(3S,5S)-3,5-dimethyl-4-morpholinyl]-2-[(6-methyl-4-pyrimidinyl)thio]ethanone IUPAC Name: 1-[(3S,5S)-3,5-dimethylmorpholin-4-yl]-2-(6-methylpyrimidin-4-yl)sulfanylethanone Traditional Name: 1-[(3S,5S)-3,5-dimethylmorpholino]-2-[(6-methylpyrimidin-4-yl)thio]ethanone Formula: C13H19N3O2S MolecularWeight: 281.37386

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Descriptors Computed from Structure

Canonical SMILES:

CC1COCC(N1C(=O)CSC2=NC=NC(=C2)C)C

Isomeric SMILES

C[C@H]1COC[C@@H](N1C(=O)CSC2=NC=NC(=C2)C)C

InChI

InChI=1S/C13H19N3O2S/c1-9-4-12(15-8-14-9)19-7-13(17)16-10(2)5-18-6-11(16)3/h4,8,10-11H,5-7H2,1-3H3/t10-,11-/m0/s1