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

Systemtic Name: 3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)-N-(pyridin-3-ylmethyl)propanamide Openeye Name: 3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)-N-(3-pyridylmethyl)propanamide CAS Name: 3-[4,6-dimethyl-2-(methylthio)-5-pyrimidinyl]-N-(3-pyridinylmethyl)propanamide IUPAC Name: 3-(4,6-dimethyl-2-methylsulfanylpyrimidin-5-yl)-N-(pyridin-3-ylmethyl)propanamide Traditional Name: 3-[4,6-dimethyl-2-(methylthio)pyrimidin-5-yl]-N-(3-pyridylmethyl)propionamide Formula: C16H20N4OS MolecularWeight: 316.4212

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)SC)C)CCC(=O)NCC2=CN=CC=C2

Isomeric SMILES

CC1=C(C(=NC(=N1)SC)C)CCC(=O)NCC2=CN=CC=C2

InChI

InChI=1S/C16H20N4OS/c1-11-14(12(2)20-16(19-11)22-3)6-7-15(21)18-10-13-5-4-8-17-9-13/h4-5,8-9H,6-7,10H2,1-3H3,(H,18,21)