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benzamide, N-[2-[[2-(cyclohexylamino)-2-oxoethyl]thio]-6-benzothiazolyl]-2-(1-pyrrolidinylcarbonyl)-
SpectraBase Compound ID 29aDx21ZbAZ
InChI InChI=1S/C27H30N4O3S2/c32-24(28-18-8-2-1-3-9-18)17-35-27-30-22-13-12-19(16-23(22)36-27)29-25(33)20-10-4-5-11-21(20)26(34)31-14-6-7-15-31/h4-5,10-13,16,18H,1-3,6-9,14-15,17H2,(H,28,32)(H,29,33)
InChIKey GSWXWTPXZXDXJH-UHFFFAOYSA-N
Mol Weight 522.68 g/mol
Molecular Formula C27H30N4O3S2
Exact Mass 522.175933 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5DGU4tntONL
Name benzamide, N-[2-[[2-(cyclohexylamino)-2-oxoethyl]thio]-6-benzothiazolyl]-2-(1-pyrrolidinylcarbonyl)-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 522.175933187 u
Formula C27H30N4O3S2
InChI InChI=1S/C27H30N4O3S2/c32-24(28-18-8-2-1-3-9-18)17-35-27-30-22-13-12-19(16-23(22)36-27)29-25(33)20-10-4-5-11-21(20)26(34)31-14-6-7-15-31/h4-5,10-13,16,18H,1-3,6-9,14-15,17H2,(H,28,32)(H,29,33)
InChIKey GSWXWTPXZXDXJH-UHFFFAOYSA-N
Molecular Weight 522.682 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_9911
Solvent DMSO-d6
Source Vendor ID: NMR/9244567; Lab Info: LP; Lab Number: LP-0609070