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

Systemtic Name: 3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)-N-[4-(pyridin-4-ylmethyl)phenyl]propanamide Openeye Name: 3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)-N-[4-(4-pyridylmethyl)phenyl]propanamide CAS Name: 3-[4,6-dimethyl-2-(methylthio)-5-pyrimidinyl]-N-[4-(pyridin-4-ylmethyl)phenyl]propanamide IUPAC Name: 3-(4,6-dimethyl-2-methylsulfanylpyrimidin-5-yl)-N-[4-(pyridin-4-ylmethyl)phenyl]propanamide Traditional Name: 3-[4,6-dimethyl-2-(methylthio)pyrimidin-5-yl]-N-[4-(4-pyridylmethyl)phenyl]propionamide Formula: C22H24N4OS MolecularWeight: 392.51716

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)SC)C)CCC(=O)NC2=CC=C(C=C2)CC3=CC=NC=C3

Isomeric SMILES

CC1=C(C(=NC(=N1)SC)C)CCC(=O)NC2=CC=C(C=C2)CC3=CC=NC=C3

InChI

InChI=1S/C22H24N4OS/c1-15-20(16(2)25-22(24-15)28-3)8-9-21(27)26-19-6-4-17(5-7-19)14-18-10-12-23-13-11-18/h4-7,10-13H,8-9,14H2,1-3H3,(H,26,27)