2-(1,3-benzodioxol-5-yl)-7-benzyl-2,3,5,6,7,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(1H)-one

SpectraBase Compound ID	yutT5t6nu9
InChI	InChI=1S/C23H21N3O3S/c27-22-20-16-8-9-26(11-14-4-2-1-3-5-14)12-19(16)30-23(20)25-21(24-22)15-6-7-17-18(10-15)29-13-28-17/h1-7,10,21,25H,8-9,11-13H2,(H,24,27)
InChIKey	PXANJWAIEGGWLM-UHFFFAOYSA-N Google Search
Mol Weight	419.5 g/mol
Molecular Formula	C23H21N3O3S
Exact Mass	419.130363 g/mol

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SpectraBase Spectrum ID	1462rFMy76N
Name	2-(1,3-benzodioxol-5-yl)-7-benzyl-2,3,5,6,7,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(1H)-one
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/C23H21N3O3S/c27-22-20-16-8-9-26(11-14-4-2-1-3-5-14)12-19(16)30-23(20)25-21(24-22)15-6-7-17-18(10-15)29-13-28-17/h1-7,10,21,25H,8-9,11-13H2,(H,24,27)
InChIKey	PXANJWAIEGGWLM-UHFFFAOYSA-N
NMR Offset	15.3548
NMR Spectrometer Frequency	300.133
Observed nucleus	1H
Origin	1H_UBI_21270_6285
Owner	Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State	soluted
Solvent	CDCl3
Source File Reference	VendorID: 62788; UBI_ID: UBI-006287
Temperature	318 °C