(5-chloranyl-2-methylsulfanyl-pyrimidin-4-yl)-[2-(hydroxymethyl)piperidin-1-yl]methanone

Systemtic Name: (5-chloranyl-2-methylsulfanyl-pyrimidin-4-yl)-[2-(hydroxymethyl)piperidin-1-yl]methanone Openeye Name: (5-chloro-2-methylsulfanyl-pyrimidin-4-yl)-[2-(hydroxymethyl)-1-piperidyl]methanone CAS Name: [5-chloro-2-(methylthio)-4-pyrimidinyl]-[2-(hydroxymethyl)-1-piperidinyl]methanone IUPAC Name: (5-chloro-2-methylsulfanylpyrimidin-4-yl)-[2-(hydroxymethyl)piperidin-1-yl]methanone Traditional Name: [5-chloro-2-(methylthio)pyrimidin-4-yl]-(2-methylolpiperidino)methanone Formula: C12H16ClN3O2S MolecularWeight: 301.79234

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC=C(C(=N1)C(=O)N2CCCCC2CO)Cl

Isomeric SMILES

CSC1=NC=C(C(=N1)C(=O)N2CCCCC2CO)Cl

InChI

InChI=1S/C12H16ClN3O2S/c1-19-12-14-6-9(13)10(15-12)11(18)16-5-3-2-4-8(16)7-17/h6,8,17H,2-5,7H2,1H3