2-(4-Chlorophenyl)-6-iodo-3-[1-(5-mercapto-1,3,4-oxadiazol-2-yl)-ethyl]-3H-quinazolin-4-one

SpectraBase Compound ID	Ee4DeGLiNfL
InChI	InChI=1S/C18H12ClIN4O2S/c1-9(16-22-23-18(27)26-16)24-15(10-2-4-11(19)5-3-10)21-14-7-6-12(20)8-13(14)17(24)25/h2-9H,1H3,(H,23,27)
InChIKey	OXBQENWRPHZODE-UHFFFAOYSA-N Google Search
Mol Weight	510.74 g/mol
Molecular Formula	C18H12ClIN4O2S
Exact Mass	509.94142 g/mol

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SpectraBase Spectrum ID	1SiRwh3X5k
Name	2-(4-Chlorophenyl)-6-iodo-3-[1-(5-mercapto-1,3,4-oxadiazol-2-yl)-ethyl]-3H-quinazolin-4-one
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C18H12ClIN4O2S
InChI	InChI=1S/C18H12ClIN4O2S/c1-9(16-22-23-18(27)26-16)24-15(10-2-4-11(19)5-3-10)21-14-7-6-12(20)8-13(14)17(24)25/h2-9H,1H3,(H,23,27)
InChIKey	OXBQENWRPHZODE-UHFFFAOYSA-N
Literature Reference DOI	10.1002/ardp.200700271
Molecular Weight	510.737 g/mol
SMILES	Sc1nnc(o1)C(C)N1C(=Nc2ccc(cc2C1=O)I)c1ccc(cc1)Cl
SPLASH	splash10-0f89-0609000000-2970f8d1f6341645d28d
Source of Spectrum	APC-341-382-4
Synonyms	2-(4-Chlorophenyl)-6-iodo-3-(1-(5-mercapto-1,3,4-oxadiazol-2-yl)ethyl)quinazolin-4(3H)-one 2-(4-Chlorophenyl)-6-iodo-3-[1-(2-sulfanylidene-3H-1,3,4-oxadiazol-5-yl)ethyl]-4-quinazolinone 2-(4-Chlorophenyl)-6-iodo-3-[1-(2-sulfanylidene-3H-1,3,4-oxadiazol-5-yl)ethyl]quinazolin-4-one 2-(4-Chlorophenyl)-6-iodanyl-3-[1-(2-sulfanylidene-3H-1,3,4-oxadiazol-5-yl)ethyl]quinazolin-4-one
Wiley ID	1768942