1-[4-(4-hydroxyphenyl)piperazin-1-yl]-2-pyrimidin-2-ylsulfanyl-ethanone

Systemtic Name: 1-[4-(4-hydroxyphenyl)piperazin-1-yl]-2-pyrimidin-2-ylsulfanyl-ethanone Openeye Name: 1-[4-(4-hydroxyphenyl)piperazin-1-yl]-2-pyrimidin-2-ylsulfanyl-ethanone CAS Name: 1-[4-(4-hydroxyphenyl)-1-piperazinyl]-2-(2-pyrimidinylthio)ethanone IUPAC Name: 1-[4-(4-hydroxyphenyl)piperazin-1-yl]-2-pyrimidin-2-ylsulfanylethanone Traditional Name: 1-[4-(4-hydroxyphenyl)piperazino]-2-(2-pyrimidylthio)ethanone Formula: C16H18N4O2S MolecularWeight: 330.40472

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)O)C(=O)CSC3=NC=CC=N3

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)O)C(=O)CSC3=NC=CC=N3

InChI

InChI=1S/C16H18N4O2S/c21-14-4-2-13(3-5-14)19-8-10-20(11-9-19)15(22)12-23-16-17-6-1-7-18-16/h1-7,21H,8-12H2