8-[(Carboxamidinylthio)methyl]-6-methyl-2-phenyl-4H-[1]-benzopyran-4-one

SpectraBase Compound ID	KINaE4FZrsN
InChI	InChI=1S/C18H16N2O2S.BrH/c1-11-7-13(10-23-18(19)20)17-14(8-11)15(21)9-16(22-17)12-5-3-2-4-6-12;/h2-9H,10H2,1H3,(H3,19,20);1H
InChIKey	KSRMJGQSQFHKSE-UHFFFAOYSA-N Google Search
Mol Weight	405.31 g/mol
Molecular Formula	C18H17BrN2O2S
Exact Mass	404.019412 g/mol

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SpectraBase Spectrum ID	GoWGOQkRcHV
Name	8-[(Carboxamidinylthio)methyl]-6-methyl-2-phenyl-4H-[1]-benzopyran-4-one
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C18H17BrN2O2S
InChI	InChI=1S/C18H16N2O2S.BrH/c1-11-7-13(10-23-18(19)20)17-14(8-11)15(21)9-16(22-17)12-5-3-2-4-6-12;/h2-9H,10H2,1H3,(H3,19,20);1H
InChIKey	KSRMJGQSQFHKSE-UHFFFAOYSA-N
Molecular Weight	405.310 g/mol
SMILES	[Br-].[NH2+]=C(SCc1c2OC(c3ccccc3)=CC(c2cc(c1)C)=O)N
SPLASH	splash10-0002-0951000000-efb8e15510f6f1734084
Source of Spectrum	D8-329-496-15
Synonyms	8-[(Aminocarbonyl-imidinyl)thiomethyl]-6-methyl-2-phenyl-4H-[1]-benzopyran-4-one
Wiley ID	1516344