ethyl 2-amino-5-cyano-6-[(2-oxo-2-phenylethyl)sulfanyl]nicotinate

SpectraBase Compound ID	5ZoSNcktzyC
InChI	InChI=1S/C17H15N3O3S/c1-2-23-17(22)13-8-12(9-18)16(20-15(13)19)24-10-14(21)11-6-4-3-5-7-11/h3-8H,2,10H2,1H3,(H2,19,20)
InChIKey	VRVYVHYWUPJKDA-UHFFFAOYSA-N Google Search
Mol Weight	341.39 g/mol
Molecular Formula	C17H15N3O3S
Exact Mass	341.083413 g/mol

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SpectraBase Spectrum ID	BDbNWaUMrmL
Name	ethyl 2-amino-5-cyano-6-[(2-oxo-2-phenylethyl)sulfanyl]nicotinate
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/C17H15N3O3S/c1-2-23-17(22)13-8-12(9-18)16(20-15(13)19)24-10-14(21)11-6-4-3-5-7-11/h3-8H,2,10H2,1H3,(H2,19,20)
InChIKey	VRVYVHYWUPJKDA-UHFFFAOYSA-N
NMR Offset	15.449
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UZI_26187_18143
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: UZI/6061705; Labnumber: SU-0000137; UZI_ID: UZI-018150
Temperature	308 °C