Benzyl [(5-nitro-1H-benzimidazol-2-yl)sulfanyl]acetate

SpectraBase Compound ID	DWj0mhvidf5
InChI	InChI=1S/C16H13N3O4S/c20-15(23-9-11-4-2-1-3-5-11)10-24-16-17-13-7-6-12(19(21)22)8-14(13)18-16/h1-8H,9-10H2,(H,17,18)
InChIKey	UYBMMAGUGWXLQZ-UHFFFAOYSA-N Google Search
Mol Weight	343.36 g/mol
Molecular Formula	C16H13N3O4S
Exact Mass	343.062677 g/mol

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SpectraBase Spectrum ID	LbTBNNRGHd1
Name	Benzyl [(5-nitro-1H-benzimidazol-2-yl)sulfanyl]acetate
CAS Registry Number	349445-14-3
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C16H13N3O4S
InChI	InChI=1S/C16H13N3O4S/c20-15(23-9-11-4-2-1-3-5-11)10-24-16-17-13-7-6-12(19(21)22)8-14(13)18-16/h1-8H,9-10H2,(H,17,18)
InChIKey	UYBMMAGUGWXLQZ-UHFFFAOYSA-N
Molecular Weight	343.357 g/mol
SMILES	[nH]1c2ccc(cc2nc1SCC(=O)OCc1ccccc1)N(=O)=O
SPLASH	splash10-00kg-9800000000-fbacf7cbbadebe74c0a3
Source of Spectrum	AD-0-2532-0
Synonyms	(phenylmethyl) 2-[(6-nitro-1H-benzimidazol-2-yl)sulfanyl]ethanoate 2-[(6-nitro-1H-benzimidazol-2-yl)thio]acetic acid (phenylmethyl) ester 2-[(6-nitro-1H-benzimidazol-2-yl)thio]acetic acid benzyl ester Acetic acid, 2-(5-nitro-2-benzimidazolyl)thio-, benzyl ester benzyl 2-[(6-nitro-1H-benzimidazol-2-yl)sulfanyl]acetate
Wiley ID	1425053