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ethyl 2-({[2-(4-ethoxyphenyl)-4-quinolinyl]carbonyl}amino)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
SpectraBase Compound ID 4nvoV2B2bRc
InChI InChI=1S/C30H30N2O4S/c1-3-35-20-16-14-19(15-17-20)25-18-23(21-10-8-9-12-24(21)31-25)28(33)32-29-27(30(34)36-4-2)22-11-6-5-7-13-26(22)37-29/h8-10,12,14-18H,3-7,11,13H2,1-2H3,(H,32,33)
InChIKey VVLLEAWANKPOIN-UHFFFAOYSA-N
Mol Weight 514.64 g/mol
Molecular Formula C30H30N2O4S
Exact Mass 514.192629 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID IlfEXRp9TIJ
Name ethyl 2-({[2-(4-ethoxyphenyl)-4-quinolinyl]carbonyl}amino)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C30H30N2O4S/c1-3-35-20-16-14-19(15-17-20)25-18-23(21-10-8-9-12-24(21)31-25)28(33)32-29-27(30(34)36-4-2)22-11-6-5-7-13-26(22)37-29/h8-10,12,14-18H,3-7,11,13H2,1-2H3,(H,32,33)
InChIKey VVLLEAWANKPOIN-UHFFFAOYSA-N
NMR Offset 14.9921
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_5379
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: UZI/8154763; UBI_ID: UBI-005381
Temperature 308 °C