For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
1-[4-[1-oxo-2-(2-pyrimidinylthio)ethyl]-1-piperazinyl]-2-(2-pyrimidinylthio)ethanone
SpectraBase Compound ID 1zP1S3lABBQ
InChI InChI=1S/C16H18N6O2S2/c23-13(11-25-15-17-3-1-4-18-15)21-7-9-22(10-8-21)14(24)12-26-16-19-5-2-6-20-16/h1-6H,7-12H2
InChIKey CBTYTPUDFLLXCO-UHFFFAOYSA-N
Mol Weight 390.48 g/mol
Molecular Formula C16H18N6O2S2
Exact Mass 390.093266 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID BAQOP2Jo0dx
Name 1-[4-[1-oxo-2-(2-pyrimidinylthio)ethyl]-1-piperazinyl]-2-(2-pyrimidinylthio)ethanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H18N6O2S2
InChI InChI=1S/C16H18N6O2S2/c23-13(11-25-15-17-3-1-4-18-15)21-7-9-22(10-8-21)14(24)12-26-16-19-5-2-6-20-16/h1-6H,7-12H2
InChIKey CBTYTPUDFLLXCO-UHFFFAOYSA-N
Molecular Weight 390.480 g/mol
SMILES c1nc(SCC(N2CCN(CC2)C(CSc2ncccn2)=O)=O)ncc1
SPLASH splash10-0fb9-7900000000-b2c75208f7f8e961d5b3
Synonyms 2-(2-pyrimidylthio)-1-[4-[2-(2-pyrimidylthio)acetyl]piperazino]ethanone 2-Pyrimidin-2-ylsulfanyl-1-[4-(2-pyrimidin-2-ylsulfanylethanoyl)piperazin-1-yl]ethanone
Wiley ID 1447009