2-(4-Bromophenylamino)-5-phenylthiazolo[2,3-b]-1,3,4-thiadiazolium bromide

SpectraBase Compound ID	LmKxbeKIQcO
InChI	InChI=1S/C16H11BrN3S2.BrH/c17-12-6-8-13(9-7-12)18-15-19-20-14(10-21-16(20)22-15)11-4-2-1-3-5-11;/h1-10H,(H,18,19);1H/q+1;/p-1
InChIKey	DOEQUBQHELMJOY-UHFFFAOYSA-M Google Search
Mol Weight	469.21 g/mol
Molecular Formula	C16H11Br2N3S2
Exact Mass	466.876116 g/mol

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SpectraBase Spectrum ID	PnNtPlCDXq
Name	2-(4-Bromophenylamino)-5-phenylthiazolo[2,3-b]-1,3,4-thiadiazolium bromide
Alternate Name(s)	2-(4-bromoanilino)-5-phenyl[1,3]thiazolo[2,3-b][1,3,4]thiadiazol-4-ium bromide
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C16H11Br2N3S2
InChI	InChI=1S/C16H11BrN3S2.BrH/c17-12-6-8-13(9-7-12)18-15-19-20-14(10-21-16(20)22-15)11-4-2-1-3-5-11;/h1-10H,(H,18,19);1H/q+1;/p-1
InChIKey	DOEQUBQHELMJOY-UHFFFAOYSA-M
Molecular Weight	469.213 g/mol
SMILES	[Br-].N(c1n[n+]2c(s1)scc2-c1ccccc1)c1ccc(Br)cc1
SPLASH	splash10-001i-0900000000-e94c32a6f89179008bb5
Source of Spectrum	SO-0-730-3
Wiley ID	1540151