3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)-N-(4-piperidin-1-ylphenyl)propanamide

Systemtic Name: 3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)-N-(4-piperidin-1-ylphenyl)propanamide Openeye Name: 3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)-N-[4-(1-piperidyl)phenyl]propanamide CAS Name: 3-[4,6-dimethyl-2-(methylthio)-5-pyrimidinyl]-N-[4-(1-piperidinyl)phenyl]propanamide IUPAC Name: 3-(4,6-dimethyl-2-methylsulfanylpyrimidin-5-yl)-N-(4-piperidin-1-ylphenyl)propanamide Traditional Name: 3-[4,6-dimethyl-2-(methylthio)pyrimidin-5-yl]-N-(4-piperidinophenyl)propionamide Formula: C21H28N4OS MolecularWeight: 384.53822

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)SC)C)CCC(=O)NC2=CC=C(C=C2)N3CCCCC3

Isomeric SMILES

CC1=C(C(=NC(=N1)SC)C)CCC(=O)NC2=CC=C(C=C2)N3CCCCC3

InChI

InChI=1S/C21H28N4OS/c1-15-19(16(2)23-21(22-15)27-3)11-12-20(26)24-17-7-9-18(10-8-17)25-13-5-4-6-14-25/h7-10H,4-6,11-14H2,1-3H3,(H,24,26)