4-ethyl-N-[3-(2-methylpiperidin-1-yl)propyl]-2-methylsulfanyl-pyrimidine-5-carboxamide

Systemtic Name: 4-ethyl-N-[3-(2-methylpiperidin-1-yl)propyl]-2-methylsulfanyl-pyrimidine-5-carboxamide Openeye Name: 4-ethyl-N-[3-(2-methyl-1-piperidyl)propyl]-2-methylsulfanyl-pyrimidine-5-carboxamide CAS Name: 4-ethyl-N-[3-(2-methyl-1-piperidinyl)propyl]-2-(methylthio)-5-pyrimidinecarboxamide IUPAC Name: 4-ethyl-N-[3-(2-methylpiperidin-1-yl)propyl]-2-methylsulfanylpyrimidine-5-carboxamide Traditional Name: 4-ethyl-N-[3-(2-methylpiperidino)propyl]-2-(methylthio)pyrimidine-5-carboxamide Formula: C17H28N4OS MolecularWeight: 336.49542

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC(=NC=C1C(=O)NCCCN2CCCCC2C)SC

Isomeric SMILES

CCC1=NC(=NC=C1C(=O)NCCCN2CCCCC2C)SC

InChI

InChI=1S/C17H28N4OS/c1-4-15-14(12-19-17(20-15)23-3)16(22)18-9-7-11-21-10-6-5-8-13(21)2/h12-13H,4-11H2,1-3H3,(H,18,22)