Vitas-M small molecule compound

2-chloro-5-[3-(quinolin-2-yl)-5-sulfanyl-4H-1,2,4-triazol-4-yl]benzoic acid

Catalog ID
STK328792
SMILES OC(=O)c1cc(ccc1Cl)n1c(S)nnc1c1ccc2c(n1)cccc2

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C18H11ClN4O2S MW 382.83 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H11ClN4O2S/c19-13-7-6-11(9-12(13)17(24)25)23-16(21-22-18(23)26)15-8-5-10-3-1-2-4-14(10)20-15/h1-9H,(H,22,26)(H,24,25)
InChIKey
ZDZHOSSQYHMSGJ-UHFFFAOYSA-N
Synonyms
728015-24-5
2chloro5(3(quinolin2yl)5sulfanyl4H124triazol4yl)benzoicacid
2chloro5(3mercapto5(quinolin2yl)4H124triazol4yl)benzoicacid
2CHLORO5(3MERCAPTO5QUINOLIN2YL(124)TRIAZOL4YL)BENZOICACID
2CHLORO5(3QUINOLIN2YL5SULFANYLIDENE1H124TRIAZOL4YL)BENZOICACID
728015245
C1=CC=C2C(=C1)C=CC(=N2)C3=NNC(=S)N3C4=CC(=C(C=C4)Cl)C(=O)O
InChI=1SC18H11ClN4O2Sc19137611(912(13)17(24)25)2316(212218(23)26)158510312414(10)2015h19H(H2226)(H2425)
MFCD06015971
ZINC5906536

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Available files

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