2-Bromanyl-N-[(2-methyl-4-nitro-5-pyrrolidin-1-yl-phenyl)carbamothioyl]benzamide

SpectraBase Compound ID	HPYIsiCEm7k
InChI	InChI=1S/C19H19BrN4O3S/c1-12-10-17(24(26)27)16(23-8-4-5-9-23)11-15(12)21-19(28)22-18(25)13-6-2-3-7-14(13)20/h2-3,6-7,10-11H,4-5,8-9H2,1H3,(H2,21,22,25,28)
InChIKey	NEDALNSRDOZBFG-UHFFFAOYSA-N Google Search
Mol Weight	463.35 g/mol
Molecular Formula	C19H19BrN4O3S
Exact Mass	462.036125 g/mol

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SpectraBase Spectrum ID	8O6dGWdTI0Z
Name	thiourea, N-(2-bromobenzoyl)-N'-[2-methyl-4-nitro-5-(1-pyrrolidinyl)phenyl]-
Copyright	Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass	462.036124659 u
Formula	C19H19BrN4O3S
InChI	InChI=1S/C19H19BrN4O3S/c1-12-10-17(24(26)27)16(23-8-4-5-9-23)11-15(12)21-19(28)22-18(25)13-6-2-3-7-14(13)20/h2-3,6-7,10-11H,4-5,8-9H2,1H3,(H2,21,22,25,28)
InChIKey	NEDALNSRDOZBFG-UHFFFAOYSA-N
Molecular Weight	463.350 g/mol
NMR Offset	18.0068
NMR Spectrometer Frequency	500.134
Observed nucleus	1H
Sample State	Soluted
Sample_ID	1H_CB_2017_16294
Solvent	DMSO-d6
Source	Vendor ID: NMR/11211694; Lab Info: LP; Lab Number: LP-2501647