(5-chloranyl-2-methylsulfanyl-pyrimidin-4-yl)-[4-(2-hydroxyethyl)piperazin-1-yl]methanone

Systemtic Name: (5-chloranyl-2-methylsulfanyl-pyrimidin-4-yl)-[4-(2-hydroxyethyl)piperazin-1-yl]methanone Openeye Name: (5-chloro-2-methylsulfanyl-pyrimidin-4-yl)-[4-(2-hydroxyethyl)piperazin-1-yl]methanone CAS Name: [5-chloro-2-(methylthio)-4-pyrimidinyl]-[4-(2-hydroxyethyl)-1-piperazinyl]methanone IUPAC Name: (5-chloro-2-methylsulfanylpyrimidin-4-yl)-[4-(2-hydroxyethyl)piperazin-1-yl]methanone Traditional Name: [5-chloro-2-(methylthio)pyrimidin-4-yl]-[4-(2-hydroxyethyl)piperazino]methanone Formula: C12H17ClN4O2S MolecularWeight: 316.80698

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC=C(C(=N1)C(=O)N2CCN(CC2)CCO)Cl

Isomeric SMILES

CSC1=NC=C(C(=N1)C(=O)N2CCN(CC2)CCO)Cl

InChI

InChI=1S/C12H17ClN4O2S/c1-20-12-14-8-9(13)10(15-12)11(19)17-4-2-16(3-5-17)6-7-18/h8,18H,2-7H2,1H3