1-[2-(4-methoxyphenyl)-4-methyl-6-(2-morpholin-4-ylethylsulfanyl)pyrimidin-5-yl]ethanone

Systemtic Name: 1-[2-(4-methoxyphenyl)-4-methyl-6-(2-morpholin-4-ylethylsulfanyl)pyrimidin-5-yl]ethanone Openeye Name: 1-[2-(4-methoxyphenyl)-4-methyl-6-(2-morpholinoethylsulfanyl)pyrimidin-5-yl]ethanone CAS Name: 1-[2-(4-methoxyphenyl)-4-methyl-6-[2-(4-morpholinyl)ethylthio]-5-pyrimidinyl]ethanone IUPAC Name: 1-[2-(4-methoxyphenyl)-4-methyl-6-(2-morpholin-4-ylethylsulfanyl)pyrimidin-5-yl]ethanone Traditional Name: 1-[2-(4-methoxyphenyl)-4-methyl-6-(2-morpholinoethylthio)pyrimidin-5-yl]ethanone Formula: C20H25N3O3S MolecularWeight: 387.4958

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)C2=CC=C(C=C2)OC)SCCN3CCOCC3)C(=O)C

Isomeric SMILES

CC1=C(C(=NC(=N1)C2=CC=C(C=C2)OC)SCCN3CCOCC3)C(=O)C

InChI

InChI=1S/C20H25N3O3S/c1-14-18(15(2)24)20(27-13-10-23-8-11-26-12-9-23)22-19(21-14)16-4-6-17(25-3)7-5-16/h4-7H,8-13H2,1-3H3