(5E)-1-cyclopropyl-5-{[(4-fluorobenzyl)amino]methylene}-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione

SpectraBase Compound ID	KulrfdtjC75
InChI	InChI=1S/C15H14FN3O2S/c16-10-3-1-9(2-4-10)7-17-8-12-13(20)18-15(22)19(14(12)21)11-5-6-11/h1-4,8,11,17H,5-7H2,(H,18,20,22)/b12-8+
InChIKey	PMXONJARWXBUEZ-XYOKQWHBSA-N Google Search
Mol Weight	319.35 g/mol
Molecular Formula	C15H14FN3O2S
Exact Mass	319.079076 g/mol

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SpectraBase Spectrum ID	FKjOk83vrP5
Name	(5E)-1-cyclopropyl-5-{[(4-fluorobenzyl)amino]methylene}-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione
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/C15H14FN3O2S/c16-10-3-1-9(2-4-10)7-17-8-12-13(20)18-15(22)19(14(12)21)11-5-6-11/h1-4,8,11,17H,5-7H2,(H,18,20,22)/b12-8+
InChIKey	PMXONJARWXBUEZ-XYOKQWHBSA-N
NMR Offset	15.328
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_17658
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: D28883; Labnumber: KKA-0211-3931; SBI_ID: SBI-017661
Synonyms	1-cyclopropyl-5-{[(4-fluorobenzyl)amino]methylene}-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione
Temperature	318 °C