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ethyl 2-[(6-{[3-(ethoxycarbonyl)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thien-2-yl]amino}-6-oxohexanoyl)amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
SpectraBase Compound ID F4Suys0w6eh
InChI InChI=1S/C30H40N2O6S2/c1-3-37-29(35)25-19-13-7-5-9-15-21(19)39-27(25)31-23(33)17-11-12-18-24(34)32-28-26(30(36)38-4-2)20-14-8-6-10-16-22(20)40-28/h3-18H2,1-2H3,(H,31,33)(H,32,34)
InChIKey ROVJDXOTEVRHKO-UHFFFAOYSA-N
Mol Weight 588.8 g/mol
Molecular Formula C30H40N2O6S2
Exact Mass 588.232779 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID HMBZbMFha4O
Name ethyl 2-[(6-{[3-(ethoxycarbonyl)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thien-2-yl]amino}-6-oxohexanoyl)amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
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/C30H40N2O6S2/c1-3-37-29(35)25-19-13-7-5-9-15-21(19)39-27(25)31-23(33)17-11-12-18-24(34)32-28-26(30(36)38-4-2)20-14-8-6-10-16-22(20)40-28/h3-18H2,1-2H3,(H,31,33)(H,32,34)
InChIKey ROVJDXOTEVRHKO-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_8108
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/9022605; UBI_ID: UBI-008111
Temperature 318 °C