N-(6-benzyl-4-oxo-2-sulfanylthieno[2,3-d]pyrimidin-3(4H)-yl)-4-ethyl-5-methyl-3-thiophenecarboxamide

SpectraBase Compound ID	KYPmaCUBugR
InChI	InChI=1S/C21H19N3O2S3/c1-3-15-12(2)28-11-17(15)18(25)23-24-20(26)16-10-14(29-19(16)22-21(24)27)9-13-7-5-4-6-8-13/h4-8,10-11H,3,9H2,1-2H3,(H,22,27)(H,23,25)
InChIKey	NJPSAOSAHDAAPB-UHFFFAOYSA-N Google Search
Mol Weight	441.58 g/mol
Molecular Formula	C21H19N3O2S3
Exact Mass	441.06394 g/mol

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SpectraBase Spectrum ID	LXK5W5ezHO
Name	N-(6-benzyl-4-oxo-2-sulfanylthieno[2,3-d]pyrimidin-3(4H)-yl)-4-ethyl-5-methyl-3-thiophenecarboxamide
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/C21H19N3O2S3/c1-3-15-12(2)28-11-17(15)18(25)23-24-20(26)16-10-14(29-19(16)22-21(24)27)9-13-7-5-4-6-8-13/h4-8,10-11H,3,9H2,1-2H3,(H,22,27)(H,23,25)
InChIKey	NJPSAOSAHDAAPB-UHFFFAOYSA-N
NMR Offset	15.328
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UZI_26187_7941
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/1269107; Labnumber: COL6462; UZI_ID: UZI-007943
Temperature	318 °C