For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
Benzoic acid, 2-[2-(3H-imidazo[4,5-b]pyridin-2-ylsulfanyl)acetylamino]-, methyl ester
SpectraBase Compound ID 3A1DW8CNgax
InChI InChI=1S/C16H14N4O3S/c1-23-15(22)10-5-2-3-6-11(10)18-13(21)9-24-16-19-12-7-4-8-17-14(12)20-16/h2-8H,9H2,1H3,(H,18,21)(H,17,19,20)
InChIKey NKHLHMCPZUWWRC-UHFFFAOYSA-N
Mol Weight 342.37 g/mol
Molecular Formula C16H14N4O3S
Exact Mass 342.078661 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 481dDOiyki
Name Benzoic acid, 2-[2-(3H-imidazo[4,5-b]pyridin-2-ylsulfanyl)acetylamino]-, methyl ester
Alternate Name(s) 2-[[2-(1H-imidazo[4,5-b]pyridin-2-ylthio)-1-oxoethyl]amino]benzoic acid methyl ester 2-[[2-(1H-imidazo[4,5-b]pyridin-2-ylthio)acetyl]amino]benzoic acid methyl ester Methyl 2-[2-(1H-imidazo[4,5-b]pyridin-2-ylsulfanyl)ethanoylamino]benzoate Methyl 2-[[2-(1H-imidazo[4,5-b]pyridin-2-ylsulfanyl)acetyl]amino]benzoate Methyl 2-{[(3H-imidazo[4,5-b]pyridin-2-ylsulfanyl)acetyl]amino}benzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H14N4O3S
InChI InChI=1S/C16H14N4O3S/c1-23-15(22)10-5-2-3-6-11(10)18-13(21)9-24-16-19-12-7-4-8-17-14(12)20-16/h2-8H,9H2,1H3,(H,18,21)(H,17,19,20)
InChIKey NKHLHMCPZUWWRC-UHFFFAOYSA-N
Molecular Weight 342.373 g/mol
SMILES [nH]1c(SCC(Nc2c(cccc2)C(=O)OC)=O)nc2cccnc12
SPLASH splash10-0gb9-4900000000-10bf0fa7effc755eb6bb
Wiley ID 1447695