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isopropyl 4-(4-sec-butylphenyl)-2-({[3-(2-chlorophenyl)-5-methyl-4-isoxazolyl]carbonyl}amino)-5-methyl-3-thiophenecarboxylate

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isopropyl 4-(4-sec-butylphenyl)-2-({[3-(2-chlorophenyl)-5-methyl-4-isoxazolyl]carbonyl}amino)-5-methyl-3-thiophenecarboxylate
SpectraBase Compound ID 76XmLNhBHjl
InChI InChI=1S/C30H31ClN2O4S/c1-7-17(4)20-12-14-21(15-13-20)25-19(6)38-29(26(25)30(35)36-16(2)3)32-28(34)24-18(5)37-33-27(24)22-10-8-9-11-23(22)31/h8-17H,7H2,1-6H3,(H,32,34)
InChIKey SBROWUCUNQAFDT-UHFFFAOYSA-N
Mol Weight 551.1 g/mol
Molecular Formula C30H31ClN2O4S
Exact Mass 550.169306 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 2blasyE8wA9
Name isopropyl 4-(4-sec-butylphenyl)-2-({[3-(2-chlorophenyl)-5-methyl-4-isoxazolyl]carbonyl}amino)-5-methyl-3-thiophenecarboxylate
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/C30H31ClN2O4S/c1-7-17(4)20-12-14-21(15-13-20)25-19(6)38-29(26(25)30(35)36-16(2)3)32-28(34)24-18(5)37-33-27(24)22-10-8-9-11-23(22)31/h8-17H,7H2,1-6H3,(H,32,34)
InChIKey SBROWUCUNQAFDT-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_20587
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/9130601; Labnumber: U_AM_ACK/052739; UZI_ID: UZI-020595
Temperature 318 °C