2-[4-methyl-6-(2-morpholin-4-yl-2-oxidanylidene-ethyl)sulfanyl-pyrimidin-2-yl]sulfanyl-1-(4-methylphenyl)ethanone

Systemtic Name: 2-[4-methyl-6-(2-morpholin-4-yl-2-oxidanylidene-ethyl)sulfanyl-pyrimidin-2-yl]sulfanyl-1-(4-methylphenyl)ethanone Openeye Name: 2-[4-methyl-6-(2-morpholino-2-oxo-ethyl)sulfanyl-pyrimidin-2-yl]sulfanyl-1-(p-tolyl)ethanone CAS Name: 2-[[4-methyl-6-[[2-(4-morpholinyl)-2-oxoethyl]thio]-2-pyrimidinyl]thio]-1-(4-methylphenyl)ethanone IUPAC Name: 2-[4-methyl-6-(2-morpholin-4-yl-2-oxoethyl)sulfanylpyrimidin-2-yl]sulfanyl-1-(4-methylphenyl)ethanone Traditional Name: 2-[[4-[(2-keto-2-morpholino-ethyl)thio]-6-methyl-pyrimidin-2-yl]thio]-1-(p-tolyl)ethanone Formula: C20H23N3O3S2 MolecularWeight: 417.54492

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)CSC2=NC(=CC(=N2)SCC(=O)N3CCOCC3)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)CSC2=NC(=CC(=N2)SCC(=O)N3CCOCC3)C

InChI

InChI=1S/C20H23N3O3S2/c1-14-3-5-16(6-4-14)17(24)12-28-20-21-15(2)11-18(22-20)27-13-19(25)23-7-9-26-10-8-23/h3-6,11H,7-10,12-13H2,1-2H3