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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)SC)C)CCC(=O)NC2=CC=CC=C2N3CCCCC3

Isomeric SMILES

CC1=C(C(=NC(=N1)SC)C)CCC(=O)NC2=CC=CC=C2N3CCCCC3

InChI

InChI=1S/C21H28N4OS/c1-15-17(16(2)23-21(22-15)27-3)11-12-20(26)24-18-9-5-6-10-19(18)25-13-7-4-8-14-25/h5-6,9-10H,4,7-8,11-14H2,1-3H3,(H,24,26)