1-(2,4-dimethylphenyl)-2-(6-morpholin-4-ylpyrimidin-4-yl)sulfanyl-ethanone

Systemtic Name: 1-(2,4-dimethylphenyl)-2-(6-morpholin-4-ylpyrimidin-4-yl)sulfanyl-ethanone Openeye Name: 1-(2,4-dimethylphenyl)-2-(6-morpholinopyrimidin-4-yl)sulfanyl-ethanone CAS Name: 1-(2,4-dimethylphenyl)-2-[[6-(4-morpholinyl)-4-pyrimidinyl]thio]ethanone IUPAC Name: 1-(2,4-dimethylphenyl)-2-(6-morpholin-4-ylpyrimidin-4-yl)sulfanylethanone Traditional Name: 1-(2,4-dimethylphenyl)-2-[(6-morpholinopyrimidin-4-yl)thio]ethanone Formula: C18H21N3O2S MolecularWeight: 343.44324

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(=O)CSC2=NC=NC(=C2)N3CCOCC3)C

Isomeric SMILES

CC1=CC(=C(C=C1)C(=O)CSC2=NC=NC(=C2)N3CCOCC3)C

InChI

InChI=1S/C18H21N3O2S/c1-13-3-4-15(14(2)9-13)16(22)11-24-18-10-17(19-12-20-18)21-5-7-23-8-6-21/h3-4,9-10,12H,5-8,11H2,1-2H3