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1-piperidinecarboxylic acid, 4-(2-[[2-[ethyl(3-methylphenyl)amino]-2-oxoethyl]thio]-4-oxo-3(4H)-quinazolinyl)-, ethyl ester
SpectraBase Compound ID DDbB3Mc1kUR
InChI InChI=1S/C27H32N4O4S/c1-4-30(21-10-8-9-19(3)17-21)24(32)18-36-26-28-23-12-7-6-11-22(23)25(33)31(26)20-13-15-29(16-14-20)27(34)35-5-2/h6-12,17,20H,4-5,13-16,18H2,1-3H3
InChIKey IJLOODPDUQSFTJ-UHFFFAOYSA-N
Mol Weight 508.6 g/mol
Molecular Formula C27H32N4O4S
Exact Mass 508.214427 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5Vr87oS9faw
Name 1-piperidinecarboxylic acid, 4-(2-[[2-[ethyl(3-methylphenyl)amino]-2-oxoethyl]thio]-4-oxo-3(4H)-quinazolinyl)-, ethyl ester
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/C27H32N4O4S/c1-4-30(21-10-8-9-19(3)17-21)24(32)18-36-26-28-23-12-7-6-11-22(23)25(33)31(26)20-13-15-29(16-14-20)27(34)35-5-2/h6-12,17,20H,4-5,13-16,18H2,1-3H3
InChIKey IJLOODPDUQSFTJ-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_8313_7007
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: NMR/10328210