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(6Z)-6-[4-(benzyloxy)-3-methoxybenzylidene]-5-imino-2-[2-oxo-2-(1-piperidinyl)ethyl]-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
SpectraBase Compound ID 4ZSrFBZYP50
InChI InChI=1S/C27H27N5O4S/c1-35-22-15-19(10-11-21(22)36-17-18-8-4-2-5-9-18)14-20-25(28)32-27(29-26(20)34)37-23(30-32)16-24(33)31-12-6-3-7-13-31/h2,4-5,8-11,14-15,28H,3,6-7,12-13,16-17H2,1H3/b20-14-,28-25?
InChIKey SIEIJPDTBDAHNS-ZVPJYGFCSA-N
Mol Weight 517.6 g/mol
Molecular Formula C27H27N5O4S
Exact Mass 517.178376 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4vEfzABluar
Name (6Z)-6-[4-(benzyloxy)-3-methoxybenzylidene]-5-imino-2-[2-oxo-2-(1-piperidinyl)ethyl]-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
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/C27H27N5O4S/c1-35-22-15-19(10-11-21(22)36-17-18-8-4-2-5-9-18)14-20-25(28)32-27(29-26(20)34)37-23(30-32)16-24(33)31-12-6-3-7-13-31/h2,4-5,8-11,14-15,28H,3,6-7,12-13,16-17H2,1H3/b20-14-,28-25?
InChIKey SIEIJPDTBDAHNS-ZVPJYGFCSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_25881
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: D61705; Labnumber: CEP5-0628; SBI_ID: SBI-025885
Synonyms 6-[4-(benzyloxy)-3-methoxybenzylidene]-5-imino-2-[2-oxo-2-(1-piperidinyl)ethyl]-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Temperature 318 °C