2-[[4-chloranyl-6-(4-methylpiperazin-1-yl)-5-methylsulfanyl-pyrimidin-2-yl]amino]ethanol

Systemtic Name: 2-[[4-chloranyl-6-(4-methylpiperazin-1-yl)-5-methylsulfanyl-pyrimidin-2-yl]amino]ethanol Openeye Name: 2-[[4-chloro-6-(4-methylpiperazin-1-yl)-5-methylsulfanyl-pyrimidin-2-yl]amino]ethanol CAS Name: 2-[[4-chloro-6-(4-methyl-1-piperazinyl)-5-(methylthio)-2-pyrimidinyl]amino]ethanol IUPAC Name: 2-[[4-chloro-6-(4-methylpiperazin-1-yl)-5-methylsulfanylpyrimidin-2-yl]amino]ethanol Traditional Name: 2-[[4-chloro-6-(4-methylpiperazino)-5-(methylthio)pyrimidin-2-yl]amino]ethanol Formula: C12H20ClN5OS MolecularWeight: 317.8381

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=C(C(=NC(=N2)NCCO)Cl)SC

Isomeric SMILES

CN1CCN(CC1)C2=C(C(=NC(=N2)NCCO)Cl)SC

InChI

InChI=1S/C12H20ClN5OS/c1-17-4-6-18(7-5-17)11-9(20-2)10(13)15-12(16-11)14-3-8-19/h19H,3-8H2,1-2H3,(H,14,15,16)