methyl 4-{[((2Z)-3-(1,3-benzodioxol-5-ylmethyl)-2-{[4-(ethoxycarbonyl)phenyl]imino}-4-oxotetrahydro-2H-1,3-thiazin-6-yl)carbonyl]amino}benzoate

SpectraBase Compound ID	68FGOU4hp9c
InChI	InChI=1S/C30H27N3O8S/c1-3-39-29(37)20-7-11-22(12-8-20)32-30-33(16-18-4-13-23-24(14-18)41-17-40-23)26(34)15-25(42-30)27(35)31-21-9-5-19(6-10-21)28(36)38-2/h4-14,25H,3,15-17H2,1-2H3,(H,31,35)/b32-30-
InChIKey	ZYURILSXRPUYPB-GCUVURNUSA-N Google Search
Mol Weight	589.62 g/mol
Molecular Formula	C30H27N3O8S
Exact Mass	589.151886 g/mol

View the Full Spectrum for FREE!

SpectraBase Spectrum ID	1lmsCncL6AK
Name	methyl 4-{[((2Z)-3-(1,3-benzodioxol-5-ylmethyl)-2-{[4-(ethoxycarbonyl)phenyl]imino}-4-oxotetrahydro-2H-1,3-thiazin-6-yl)carbonyl]amino}benzoate
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/C30H27N3O8S/c1-3-39-29(37)20-7-11-22(12-8-20)32-30-33(16-18-4-13-23-24(14-18)41-17-40-23)26(34)15-25(42-30)27(35)31-21-9-5-19(6-10-21)28(36)38-2/h4-14,25H,3,15-17H2,1-2H3,(H,31,35)/b32-30-
InChIKey	ZYURILSXRPUYPB-GCUVURNUSA-N
NMR Offset	18.0059
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_18805
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: D11720; Labnumber: MPOL-13219; SBI_ID: SBI-018808
Synonyms	methyl 4-{[(3-(1,3-benzodioxol-5-ylmethyl)-2-{[4-(ethoxycarbonyl)phenyl]imino}-4-oxotetrahydro-2H-1,3-thiazin-6-yl)carbonyl]amino}benzoate
Temperature	306 °C