5-(4-chlorophenyl)-2,8-bis(methylsulfanyl)-5,9-dihydro-4H-pyrimido[5',4':5,6]pyrano[2,3-d]pyrimidine-4,6(1H)-dione

SpectraBase Compound ID	Eeifxz4EBCI
InChI	InChI=1S/C17H13ClN4O3S2/c1-26-16-19-12(23)10-9(7-3-5-8(18)6-4-7)11-13(24)20-17(27-2)22-15(11)25-14(10)21-16/h3-6,9H,1-2H3,(H,19,21,23)(H,20,22,24)
InChIKey	KLWUIENBTVYNLB-UHFFFAOYSA-N Google Search
Mol Weight	420.89 g/mol
Molecular Formula	C17H13ClN4O3S2
Exact Mass	420.01176 g/mol

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SpectraBase Spectrum ID	5qQkRx13Ygq
Name	5-(4-chlorophenyl)-2,8-bis(methylsulfanyl)-5,9-dihydro-4H-pyrimido[5',4':5,6]pyrano[2,3-d]pyrimidine-4,6(1H)-dione
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/C17H13ClN4O3S2/c1-26-16-19-12(23)10-9(7-3-5-8(18)6-4-7)11-13(24)20-17(27-2)22-15(11)25-14(10)21-16/h3-6,9H,1-2H3,(H,19,21,23)(H,20,22,24)
InChIKey	KLWUIENBTVYNLB-UHFFFAOYSA-N
NMR Offset	15.328
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_5612
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: D23126; Labnumber: KVEX-30086; SBI_ID: SBI-005614
Temperature	318 °C