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1-(2,4-dichlorophenyl)-4-(4-ethoxyphenyl)-N-phenyl-5,6,7,8-tetrahydro-2,2a,8a-triazacyclopenta[cd]azulene-3-carbothioamide

View entire compound with spectra: 1 NMR

1-(2,4-dichlorophenyl)-4-(4-ethoxyphenyl)-N-phenyl-5,6,7,8-tetrahydro-2,2a,8a-triazacyclopenta[cd]azulene-3-carbothioamide
SpectraBase Compound ID 4xAzLooZD6I
InChI InChI=1S/C30H26Cl2N4OS/c1-2-37-22-14-11-19(12-15-22)26-24-10-6-7-17-35-28(23-16-13-20(31)18-25(23)32)34-36(30(24)35)27(26)29(38)33-21-8-4-3-5-9-21/h3-5,8-9,11-16,18H,2,6-7,10,17H2,1H3,(H,33,38)
InChIKey FDOIIVIACQKELP-UHFFFAOYSA-N
Mol Weight 561.53 g/mol
Molecular Formula C30H26Cl2N4OS
Exact Mass 560.120438 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 8ofqc2piT1D
Name 1-(2,4-dichlorophenyl)-4-(4-ethoxyphenyl)-N-phenyl-5,6,7,8-tetrahydro-2,2a,8a-triazacyclopenta[cd]azulene-3-carbothioamide
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2025 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2025 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C30H26Cl2N4OS/c1-2-37-22-14-11-19(12-15-22)26-24-10-6-7-17-35-28(23-16-13-20(31)18-25(23)32)34-36(30(24)35)27(26)29(38)33-21-8-4-3-5-9-21/h3-5,8-9,11-16,18H,2,6-7,10,17H2,1H3,(H,33,38)
InChIKey FDOIIVIACQKELP-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_13019
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: D77529; Labnumber: EXDem1-0506; SBI_ID: SBI-013022
Temperature 315 °C