Vitas-M small molecule compound
5-(diethylammonio)-2-[(E)-{[3-(pyridin-2-yl)-5-thioxo-1,5-dihydro-4H-1,2,4-triazol-4-yl]imino}methyl]phenolate
Catalog ID
STK569561
SMILES CC[NH+](c1ccc(c(c1)[O-])/C=N/n1c(=S)[nH]nc1c1ccccn1)CC
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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 C18H20N6OS MW 368.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H20N6OS/c1-3-23(4-2)14-9-8-13(16(25)11-14)12-20-24-17(21-22-18(24)26)15-7-5-6-10-19-15/h5-12,25H,3-4H2,1-2H3,(H,22,26)/b20-12+InChIKey
KDTZGHHAPZDTBF-UDWIEESQSA-NSynonyms
497823-69-5497823695
5(diethylammonio)2((E)((3(pyridin2yl)5thioxo15dihydro4H124triazol4yl)imino)methyl)phenolate
5(DIETHYLAZANIUMYL)2((E)(3PYRIDIN2YL5SULFANYLIDENE1H124TRIAZOL4YL)IMINOMETHYL)PHENOLATE
CC(NH+)(c1ccc(c(c1)(O))C=Nn1c(=S)(nH)nc1c1ccccn1)CC
CC(NH+)(CC)C1=CC(=C(C=C1)C=NN2C(=NNC2=S)C3=CC=CC=N3)(O)
InChI=1SC18H20N6OSc1323(42)149813(16(25)1114)12202417(212218(24)26)15756101915h51225H34H212H3(H2226)b2012+
MFCD18245304
ZINC000005643995
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