N-[1-(4-methyl-2-pyridin-4-yl-pyrimidin-5-yl)ethyl]-3-methylsulfanyl-propanamide

Systemtic Name: N-[1-(4-methyl-2-pyridin-4-yl-pyrimidin-5-yl)ethyl]-3-methylsulfanyl-propanamide Openeye Name: N-[1-[4-methyl-2-(4-pyridyl)pyrimidin-5-yl]ethyl]-3-methylsulfanyl-propanamide CAS Name: N-[1-(4-methyl-2-pyridin-4-yl-5-pyrimidinyl)ethyl]-3-(methylthio)propanamide IUPAC Name: N-[1-(4-methyl-2-pyridin-4-ylpyrimidin-5-yl)ethyl]-3-methylsulfanylpropanamide Traditional Name: N-[1-[4-methyl-2-(4-pyridyl)pyrimidin-5-yl]ethyl]-3-(methylthio)propionamide Formula: C16H20N4OS MolecularWeight: 316.4212

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC=C1C(C)NC(=O)CCSC)C2=CC=NC=C2

Isomeric SMILES

CC1=NC(=NC=C1C(C)NC(=O)CCSC)C2=CC=NC=C2

InChI

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