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1-piperazinecarboxamide, 4-[2-[[(1Z)-1-[1-(2-benzothiazolyl)-1,5-dihydro-5-oxo-3-phenyl-4H-pyrazol-4-ylidene]ethyl]amino]ethyl]-N-(3,4-

View entire compound with spectra: 1 NMR

1-piperazinecarboxamide, 4-[2-[[(1Z)-1-[1-(2-benzothiazolyl)-1,5-dihydro-5-oxo-3-phenyl-4H-pyrazol-4-ylidene]ethyl]amino]ethyl]-N-(3,4-
SpectraBase Compound ID 2CGxPJPpcdg
InChI InChI=1S/C31H29Cl2N7O2S/c1-20(34-13-14-38-15-17-39(18-16-38)30(42)35-22-11-12-23(32)24(33)19-22)27-28(21-7-3-2-4-8-21)37-40(29(27)41)31-36-25-9-5-6-10-26(25)43-31/h2-12,19,34H,13-18H2,1H3,(H,35,42)/b27-20-
InChIKey OBOKJNNCKLGQHX-OOAXWGSJSA-N
Mol Weight 634.59 g/mol
Molecular Formula C31H29Cl2N7O2S
Exact Mass 633.14805 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID AZZrtX5q8I3
Name 1-piperazinecarboxamide, 4-[2-[[(1Z)-1-[1-(2-benzothiazolyl)-1,5-dihydro-5-oxo-3-phenyl-4H-pyrazol-4-ylidene]ethyl]amino]ethyl]-N-(3,4-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 633.148049774 u
Formula C31H29Cl2N7O2S
InChI InChI=1S/C31H29Cl2N7O2S/c1-20(34-13-14-38-15-17-39(18-16-38)30(42)35-22-11-12-23(32)24(33)19-22)27-28(21-7-3-2-4-8-21)37-40(29(27)41)31-36-25-9-5-6-10-26(25)43-31/h2-12,19,34H,13-18H2,1H3,(H,35,42)/b27-20-
InChIKey OBOKJNNCKLGQHX-OOAXWGSJSA-N
Molecular Weight 634.586 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_14249
Solvent DMSO-d6
Source Vendor ID: NMR/10300923; Lab Info: PRE; Lab Number: PRE-0009701