2-(2-chloro-1H-indol-3-yl)-2,3,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-4(1H)-one

SpectraBase Compound ID	12P7nsXqwZQ
InChI	InChI=1S/C18H16ClN3OS/c19-15-13(9-5-1-3-7-11(9)20-15)16-21-17(23)14-10-6-2-4-8-12(10)24-18(14)22-16/h1,3,5,7,16,20,22H,2,4,6,8H2,(H,21,23)
InChIKey	RZPBKRHDOJRQPO-UHFFFAOYSA-N Google Search
Mol Weight	357.86 g/mol
Molecular Formula	C18H16ClN3OS
Exact Mass	357.070261 g/mol

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SpectraBase Spectrum ID	248Dw5Hejqb
Name	2-(2-chloro-1H-indol-3-yl)-2,3,5,6,7,8-hexahydro[1]benzothieno[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/C18H16ClN3OS/c19-15-13(9-5-1-3-7-11(9)20-15)16-21-17(23)14-10-6-2-4-8-12(10)24-18(14)22-16/h1,3,5,7,16,20,22H,2,4,6,8H2,(H,21,23)
InChIKey	RZPBKRHDOJRQPO-UHFFFAOYSA-N
NMR Offset	15.3548
NMR Spectrometer Frequency	300.133
Observed nucleus	1H
Origin	1H_UBI_21270_6286
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: 62789; UBI_ID: UBI-006288
Temperature	318 °C