1-(3-methylpiperidin-1-yl)-2-pyrimidin-2-ylsulfanyl-ethanone

Systemtic Name: 1-(3-methylpiperidin-1-yl)-2-pyrimidin-2-ylsulfanyl-ethanone Openeye Name: 1-(3-methyl-1-piperidyl)-2-pyrimidin-2-ylsulfanyl-ethanone CAS Name: 1-(3-methyl-1-piperidinyl)-2-(2-pyrimidinylthio)ethanone IUPAC Name: 1-(3-methylpiperidin-1-yl)-2-pyrimidin-2-ylsulfanylethanone Traditional Name: 1-(3-methylpiperidino)-2-(2-pyrimidylthio)ethanone Formula: C12H17N3OS MolecularWeight: 251.34788

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C(=O)CSC2=NC=CC=N2

Isomeric SMILES

CC1CCCN(C1)C(=O)CSC2=NC=CC=N2

InChI

InChI=1S/C12H17N3OS/c1-10-4-2-7-15(8-10)11(16)9-17-12-13-5-3-6-14-12/h3,5-6,10H,2,4,7-9H2,1H3