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

Systemtic Name: 3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)-N-[phenyl(thiophen-2-yl)methyl]propanamide Openeye Name: 3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)-N-[phenyl(2-thienyl)methyl]propanamide CAS Name: 3-[4,6-dimethyl-2-(methylthio)-5-pyrimidinyl]-N-[phenyl(thiophen-2-yl)methyl]propanamide IUPAC Name: 3-(4,6-dimethyl-2-methylsulfanylpyrimidin-5-yl)-N-[phenyl(thiophen-2-yl)methyl]propanamide Traditional Name: 3-[4,6-dimethyl-2-(methylthio)pyrimidin-5-yl]-N-[phenyl(2-thienyl)methyl]propionamide Formula: C21H23N3OS2 MolecularWeight: 397.55682

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)SC)C)CCC(=O)NC(C2=CC=CC=C2)C3=CC=CS3

Isomeric SMILES

CC1=C(C(=NC(=N1)SC)C)CCC(=O)NC(C2=CC=CC=C2)C3=CC=CS3

InChI

InChI=1S/C21H23N3OS2/c1-14-17(15(2)23-21(22-14)26-3)11-12-19(25)24-20(18-10-7-13-27-18)16-8-5-4-6-9-16/h4-10,13,20H,11-12H2,1-3H3,(H,24,25)