(5-chloranyl-2-methylsulfanyl-pyrimidin-4-yl)-[3-(hydroxymethyl)piperidin-1-yl]methanone

Systemtic Name: (5-chloranyl-2-methylsulfanyl-pyrimidin-4-yl)-[3-(hydroxymethyl)piperidin-1-yl]methanone Openeye Name: (5-chloro-2-methylsulfanyl-pyrimidin-4-yl)-[3-(hydroxymethyl)-1-piperidyl]methanone CAS Name: [5-chloro-2-(methylthio)-4-pyrimidinyl]-[3-(hydroxymethyl)-1-piperidinyl]methanone IUPAC Name: (5-chloro-2-methylsulfanylpyrimidin-4-yl)-[3-(hydroxymethyl)piperidin-1-yl]methanone Traditional Name: [5-chloro-2-(methylthio)pyrimidin-4-yl]-(3-methylolpiperidino)methanone Formula: C12H16ClN3O2S MolecularWeight: 301.79234

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC=C(C(=N1)C(=O)N2CCCC(C2)CO)Cl

Isomeric SMILES

CSC1=NC=C(C(=N1)C(=O)N2CCCC(C2)CO)Cl

InChI

InChI=1S/C12H16ClN3O2S/c1-19-12-14-5-9(13)10(15-12)11(18)16-4-2-3-8(6-16)7-17/h5,8,17H,2-4,6-7H2,1H3