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

Systemtic Name: 3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)-N-[4-(2-morpholin-4-ylethanoylamino)phenyl]propanamide Openeye Name: 3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)-N-[4-[(2-morpholinoacetyl)amino]phenyl]propanamide CAS Name: 3-[4,6-dimethyl-2-(methylthio)-5-pyrimidinyl]-N-[4-[[2-(4-morpholinyl)-1-oxoethyl]amino]phenyl]propanamide IUPAC Name: 3-(4,6-dimethyl-2-methylsulfanylpyrimidin-5-yl)-N-[4-[(2-morpholin-4-ylacetyl)amino]phenyl]propanamide Traditional Name: 3-[4,6-dimethyl-2-(methylthio)pyrimidin-5-yl]-N-[4-[(2-morpholinoacetyl)amino]phenyl]propionamide Formula: C22H29N5O3S MolecularWeight: 443.56236

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)SC)C)CCC(=O)NC2=CC=C(C=C2)NC(=O)CN3CCOCC3

Isomeric SMILES

CC1=C(C(=NC(=N1)SC)C)CCC(=O)NC2=CC=C(C=C2)NC(=O)CN3CCOCC3

InChI

InChI=1S/C22H29N5O3S/c1-15-19(16(2)24-22(23-15)31-3)8-9-20(28)25-17-4-6-18(7-5-17)26-21(29)14-27-10-12-30-13-11-27/h4-7H,8-14H2,1-3H3,(H,25,28)(H,26,29)