2-methylsulfanyl-1-(4-pyrimidin-2-ylpiperazin-1-yl)propan-1-one

Systemtic Name: 2-methylsulfanyl-1-(4-pyrimidin-2-ylpiperazin-1-yl)propan-1-one Openeye Name: 2-methylsulfanyl-1-(4-pyrimidin-2-ylpiperazin-1-yl)propan-1-one CAS Name: 2-(methylthio)-1-[4-(2-pyrimidinyl)-1-piperazinyl]-1-propanone IUPAC Name: 2-methylsulfanyl-1-(4-pyrimidin-2-ylpiperazin-1-yl)propan-1-one Traditional Name: 2-(methylthio)-1-[4-(2-pyrimidyl)piperazino]propan-1-one Formula: C12H18N4OS MolecularWeight: 266.36252

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCN(CC1)C2=NC=CC=N2)SC

Isomeric SMILES

CC(C(=O)N1CCN(CC1)C2=NC=CC=N2)SC

InChI

InChI=1S/C12H18N4OS/c1-10(18-2)11(17)15-6-8-16(9-7-15)12-13-4-3-5-14-12/h3-5,10H,6-9H2,1-2H3