4-[({[(2E)-3-(4-isopropylphenyl)-2-propenoyl]amino}carbothioyl)amino]benzenesulfonamide

SpectraBase Compound ID	LjEAKpq7b8m
InChI	InChI=1S/C19H21N3O3S2/c1-13(2)15-6-3-14(4-7-15)5-12-18(23)22-19(26)21-16-8-10-17(11-9-16)27(20,24)25/h3-13H,1-2H3,(H2,20,24,25)(H2,21,22,23,26)/b12-5+
InChIKey	RDIWUSOPFKMMON-LFYBBSHMSA-N Google Search
Mol Weight	403.51 g/mol
Molecular Formula	C19H21N3O3S2
Exact Mass	403.102434 g/mol

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SpectraBase Spectrum ID	EUw67l1pCtn
Name	4-[({[(2E)-3-(4-isopropylphenyl)-2-propenoyl]amino}carbothioyl)amino]benzenesulfonamide
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/C19H21N3O3S2/c1-13(2)15-6-3-14(4-7-15)5-12-18(23)22-19(26)21-16-8-10-17(11-9-16)27(20,24)25/h3-13H,1-2H3,(H2,20,24,25)(H2,21,22,23,26)/b12-5+
InChIKey	RDIWUSOPFKMMON-LFYBBSHMSA-N
NMR Offset	15.5012
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_7427
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: D29746; Labnumber: NNOBK-1082; SBI_ID: SBI-007430
Synonyms	4-[({[3-(4-isopropylphenyl)-2-propenoyl]amino}carbothioyl)amino]benzenesulfonamide
Temperature	315 °C