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(6Z)-6-({1-[3-(2-chlorophenoxy)propyl]-1H-indol-3-yl}methylene)-5-imino-2-methyl-5,6-dihydro-7H-[1,3]thiazolo[3,2-a]pyrimidin-7-one
SpectraBase Compound ID KJWl1RFCdQU
InChI InChI=1S/C25H21ClN4O2S/c1-16-14-30-23(27)19(24(31)28-25(30)33-16)13-17-15-29(21-9-4-2-7-18(17)21)11-6-12-32-22-10-5-3-8-20(22)26/h2-5,7-10,13-15,27H,6,11-12H2,1H3/b19-13-,27-23?
InChIKey BFXBBUFZXNGDRS-XGCFFSCVSA-N
Mol Weight 476.98 g/mol
Molecular Formula C25H21ClN4O2S
Exact Mass 476.107375 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID J1UClTLUOnA
Name (6Z)-6-({1-[3-(2-chlorophenoxy)propyl]-1H-indol-3-yl}methylene)-5-imino-2-methyl-5,6-dihydro-7H-[1,3]thiazolo[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/C25H21ClN4O2S/c1-16-14-30-23(27)19(24(31)28-25(30)33-16)13-17-15-29(21-9-4-2-7-18(17)21)11-6-12-32-22-10-5-3-8-20(22)26/h2-5,7-10,13-15,27H,6,11-12H2,1H3/b19-13-,27-23?
InChIKey BFXBBUFZXNGDRS-XGCFFSCVSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_28194
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: D80977; Labnumber: CEP4-2929; SBI_ID: SBI-028198
Synonyms 6-({1-[3-(2-chlorophenoxy)propyl]-1H-indol-3-yl}methylene)-5-imino-2-methyl-5,6-dihydro-7H-[1,3]thiazolo[3,2-a]pyrimidin-7-one
Temperature 318 °C