(2R)-2-phenylsulfanyl-1-(4-pyrimidin-2-ylpiperazin-1-yl)propan-1-one

Systemtic Name: (2R)-2-phenylsulfanyl-1-(4-pyrimidin-2-ylpiperazin-1-yl)propan-1-one Openeye Name: (2R)-2-phenylsulfanyl-1-(4-pyrimidin-2-ylpiperazin-1-yl)propan-1-one CAS Name: (2R)-2-(phenylthio)-1-[4-(2-pyrimidinyl)-1-piperazinyl]-1-propanone IUPAC Name: (2R)-2-phenylsulfanyl-1-(4-pyrimidin-2-ylpiperazin-1-yl)propan-1-one Traditional Name: (2R)-2-(phenylthio)-1-[4-(2-pyrimidyl)piperazino]propan-1-one Formula: C17H20N4OS MolecularWeight: 328.4319

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCN(CC1)C2=NC=CC=N2)SC3=CC=CC=C3

Isomeric SMILES

C[C@H](C(=O)N1CCN(CC1)C2=NC=CC=N2)SC3=CC=CC=C3

InChI

InChI=1S/C17H20N4OS/c1-14(23-15-6-3-2-4-7-15)16(22)20-10-12-21(13-11-20)17-18-8-5-9-19-17/h2-9,14H,10-13H2,1H3/t14-/m1/s1