methyl 2-({[3-(2,6-dichlorophenyl)-5-methyl-4-isoxazolyl]carbonyl}amino)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate

SpectraBase Compound ID	DLD1FpYD9U7
InChI	InChI=1S/C22H20Cl2N2O4S/c1-11-16(19(26-30-11)18-13(23)8-6-9-14(18)24)20(27)25-21-17(22(28)29-2)12-7-4-3-5-10-15(12)31-21/h6,8-9H,3-5,7,10H2,1-2H3,(H,25,27)
InChIKey	IXNSSEUDOHEJIT-UHFFFAOYSA-N Google Search
Mol Weight	479.38 g/mol
Molecular Formula	C22H20Cl2N2O4S
Exact Mass	478.052084 g/mol

View the Full Spectrum for FREE!

SpectraBase Spectrum ID	2SjZYyUsBLm
Name	methyl 2-({[3-(2,6-dichlorophenyl)-5-methyl-4-isoxazolyl]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/C22H20Cl2N2O4S/c1-11-16(19(26-30-11)18-13(23)8-6-9-14(18)24)20(27)25-21-17(22(28)29-2)12-7-4-3-5-10-15(12)31-21/h6,8-9H,3-5,7,10H2,1-2H3,(H,25,27)
InChIKey	IXNSSEUDOHEJIT-UHFFFAOYSA-N
NMR Offset	15.328
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UZI_26187_14231
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/9026789; Labnumber: NSB0060257; UZI_ID: UZI-014235
Temperature	318 °C