ethyl (2E)-[(2E)-2-(2-amino-1-cyano-2-oxoethylidene)-3-(4-bromophenyl)-4-oxo-1,3-thiazolidin-5-ylidene]ethanoate

SpectraBase Compound ID	GqBCveIpjEr
InChI	InChI=1S/C16H12BrN3O4S/c1-2-24-13(21)7-12-15(23)20(10-5-3-9(17)4-6-10)16(25-12)11(8-18)14(19)22/h3-7H,2H2,1H3,(H2,19,22)/b12-7+,16-11+
InChIKey	GAQYAEXNLBRVLP-OHAJNEHYSA-N Google Search
Mol Weight	422.25 g/mol
Molecular Formula	C16H12BrN3O4S
Exact Mass	420.97319 g/mol

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SpectraBase Spectrum ID	1tM6HyNFTj3
Name	ethyl (2E)-[(2E)-2-(2-amino-1-cyano-2-oxoethylidene)-3-(4-bromophenyl)-4-oxo-1,3-thiazolidin-5-ylidene]ethanoate
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/C16H12BrN3O4S/c1-2-24-13(21)7-12-15(23)20(10-5-3-9(17)4-6-10)16(25-12)11(8-18)14(19)22/h3-7H,2H2,1H3,(H2,19,22)/b12-7+,16-11+
InChIKey	GAQYAEXNLBRVLP-OHAJNEHYSA-N
NMR Offset	15.449
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_11918
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: D66124; Labnumber: EXP17Mat001845; SBI_ID: SBI-011921
Synonyms	ethyl [2-(2-amino-1-cyano-2-oxoethylidene)-3-(4-bromophenyl)-4-oxo-1,3-thiazolidin-5-ylidene]ethanoate
Temperature	308 °C