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4-[4-Picolyl]piperazine-1-carbothioic acid, 2-[1-[2-pyridyl]ethylidene]

View entire compound with spectra: 1 NMR

4-[4-Picolyl]piperazine-1-carbothioic acid, 2-[1-[2-pyridyl]ethylidene]
SpectraBase Compound ID 6yJDlLk2RN2
InChI InChI=1S/C18H22N6S/c1-15(17-4-2-3-7-20-17)21-22-18(25)24-12-10-23(11-13-24)14-16-5-8-19-9-6-16/h2-9H,10-14H2,1H3,(H,22,25)/b21-15-
InChIKey XWXQYUZZLIRFDT-QNGOZBTKSA-N
Mol Weight 354.48 g/mol
Molecular Formula C18H22N6S
Exact Mass 354.162666 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KqMyGYcbDIn
Name 4-[4-Picolyl]piperazine-1-carbothioic acid, 2-[1-[2-pyridyl]ethylidene]
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 354.162665906 u
Formula C18H22N6S
InChI InChI=1S/C18H22N6S/c1-15(17-4-2-3-7-20-17)21-22-18(25)24-12-10-23(11-13-24)14-16-5-8-19-9-6-16/h2-9H,10-14H2,1H3,(H,22,25)/b21-15-
InChIKey XWXQYUZZLIRFDT-QNGOZBTKSA-N
Molecular Weight 354.476 g/mol
SMILES C1=C(N=CC=C1)\C(=N/NC(=S)N1CCN(CC1)CC1=CC=NC=C1)C