2-[(2-phenyl-5,6,7,8-tetrahydroquinazolin-4-yl)thio]acetic acid methyl ester

SpectraBase Compound ID	1p0v0z3pGCn
InChI	InChI=1S/C17H18N2O2S/c1-21-15(20)11-22-17-13-9-5-6-10-14(13)18-16(19-17)12-7-3-2-4-8-12/h2-4,7-8H,5-6,9-11H2,1H3
InChIKey	LGFRTQWOTFTCNY-UHFFFAOYSA-N Google Search
Mol Weight	314.4 g/mol
Molecular Formula	C17H18N2O2S
Exact Mass	314.108899 g/mol

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SpectraBase Spectrum ID	A9FYspwvIIS
Name	2-[(2-phenyl-5,6,7,8-tetrahydroquinazolin-4-yl)thio]acetic acid methyl ester
CAS Registry Number	107466-59-1
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C17H18N2O2S
InChI	InChI=1S/C17H18N2O2S/c1-21-15(20)11-22-17-13-9-5-6-10-14(13)18-16(19-17)12-7-3-2-4-8-12/h2-4,7-8H,5-6,9-11H2,1H3
InChIKey	LGFRTQWOTFTCNY-UHFFFAOYSA-N
Molecular Weight	314.403 g/mol
SMILES	c1(nc(nc2CCCCc12)-c1ccccc1)SCC(=O)OC
SPLASH	splash10-01qd-0192000000-63f6727d9ffd32e2639a
Source of Spectrum	H-69-1023-15
Synonyms	Methyl 2-[(2-phenyl-5,6,7,8-tetrahydroquinazolin-4-yl)sulfanyl]acetate Methyl 2-[(2-phenyl-5,6,7,8-tetrahydroquinazolin-4-yl)sulfanyl]ethanoate
Wiley ID	1314995