SpectraBase Spectrum ID |
FwiSJh8g8V1 |
Name |
2-(([(5,6-Dimethyl-1H-benzimidazol-2-yl)sulfanyl]acetyl)amino)benzoic acid |
CAS Registry Number |
302601-83-8 |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C18H17N3O3S |
InChI |
InChI=1S/C18H17N3O3S/c1-10-7-14-15(8-11(10)2)21-18(20-14)25-9-16(22)19-13-6-4-3-5-12(13)17(23)24/h3-8H,9H2,1-2H3,(H,19,22)(H,20,21)(H,23,24) |
InChIKey |
QNSKNMXVQLGIPC-UHFFFAOYSA-N |
Molecular Weight |
355.412 g/mol |
SMILES |
[nH]1c(SCC(=O)Nc2c(C(=O)O)cccc2)nc2c1cc(c(c2)C)C |
SPLASH |
splash10-0006-9500000000-3897b5c417c0f79c00bd |
Synonyms |
2-[2-(5,6-Dimethyl-1H-benzimidazol-2-ylthio)acetamido]benzoic acid
2-[2-[(5,6-dimethyl-1H-benzimidazol-2-yl)sulfanyl]ethanoylamino]benzoic acid
2-[[2-[(5,6-dimethyl-1H-benzimidazol-2-yl)sulfanyl]acetyl]amino]benzoic acid
2-[[2-[(5,6-dimethyl-1H-benzimidazol-2-yl)thio]-1-oxoethyl]amino]benzoic acid
2-[[2-[(5,6-dimethyl-1H-benzimidazol-2-yl)thio]acetyl]amino]benzoic acid |
Wiley ID |
1469060 |