(2S)-4-methyl-2-(5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-ylamino)pentanoic acid

SpectraBase Compound ID	9Vx4JHRaHgz
InChI	InChI=1S/C16H21N3O2S/c1-9(2)7-11(16(20)21)19-14-13-10-5-3-4-6-12(10)22-15(13)18-8-17-14/h8-9,11H,3-7H2,1-2H3,(H,20,21)(H,17,18,19)
InChIKey	YWVCOSWLUPQJFC-UHFFFAOYSA-N Google Search
Mol Weight	319.42 g/mol
Molecular Formula	C16H21N3O2S
Exact Mass	319.135448 g/mol

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SpectraBase Spectrum ID	4xoR1P3J8oh
Name	(2S)-4-methyl-2-(5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-ylamino)pentanoic acid
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/C16H21N3O2S/c1-9(2)7-11(16(20)21)19-14-13-10-5-3-4-6-12(10)22-15(13)18-8-17-14/h8-9,11H,3-7H2,1-2H3,(H,20,21)(H,17,18,19)
InChIKey	YWVCOSWLUPQJFC-UHFFFAOYSA-N
NMR Offset	15.3537
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UBI-VK_18310_7627
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: 129697; Labnumber: EXP11T0007; VK_ID: VK-007631
Synonyms	4-methyl-2-(5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-ylamino)pentanoic acid
Temperature	308 °C