3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)-N-(2-methyl-4-morpholin-4-yl-phenyl)propanamide

Systemtic Name: 3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)-N-(2-methyl-4-morpholin-4-yl-phenyl)propanamide Openeye Name: 3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)-N-(2-methyl-4-morpholino-phenyl)propanamide CAS Name: 3-[4,6-dimethyl-2-(methylthio)-5-pyrimidinyl]-N-[2-methyl-4-(4-morpholinyl)phenyl]propanamide IUPAC Name: 3-(4,6-dimethyl-2-methylsulfanylpyrimidin-5-yl)-N-(2-methyl-4-morpholin-4-ylphenyl)propanamide Traditional Name: 3-[4,6-dimethyl-2-(methylthio)pyrimidin-5-yl]-N-(2-methyl-4-morpholino-phenyl)propionamide Formula: C21H28N4O2S MolecularWeight: 400.53762

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)N2CCOCC2)NC(=O)CCC3=C(N=C(N=C3C)SC)C

Isomeric SMILES

CC1=C(C=CC(=C1)N2CCOCC2)NC(=O)CCC3=C(N=C(N=C3C)SC)C

InChI

InChI=1S/C21H28N4O2S/c1-14-13-17(25-9-11-27-12-10-25)5-7-19(14)24-20(26)8-6-18-15(2)22-21(28-4)23-16(18)3/h5,7,13H,6,8-12H2,1-4H3,(H,24,26)