Vitas-M small molecule compound
2-ethyl-7-[5-(methylsulfanyl)-4H-1,2,4-triazol-3-yl]-3-phenylpyrazolo[5,1-c]pyrido[4,3-e][1,2,4]triazin-6(7H)-one
Catalog ID
STK790257
SMILES CCc1nn2c(c1c1ccccc1)nnc1c2ccn(c1=O)c1nnc([nH]1)SC
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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 C19H16N8OS MW 404.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H16N8OS/c1-3-12-14(11-7-5-4-6-8-11)16-22-21-15-13(27(16)25-12)9-10-26(17(15)28)18-20-19(29-2)24-23-18/h4-10H,3H2,1-2H3,(H,20,23,24)InChIKey
WFRIFDXEZJKWQW-UHFFFAOYSA-NSynonyms
1010910-37-81010910378
2ethyl7(5(methylsulfanyl)4H124triazol3yl)3phenylpyrazolo(51c)pyrido(43e)(124)triazin6(7H)one
2ethyl7(5(methylthio)4H124triazol3yl)3phenylpyrazolo(51c)pyrido(43e)(124)triazin6(7H)one
CCC1=NN2C3=C(C(=O)N(C=C3)C4=NC(=NN4)SC)N=NC2=C1C5=CC=CC=C5
CCc1nn2c(c1c1ccccc1)nnc1c2ccn(c1=O)c1nnc((nH)1)SC
InChI=1SC19H16N8OSc131214(117546811)1622211513(27(16)2512)91026(17(15)28)182019(292)242318h410H3H212H3(H202324)
MFCD11083346
ZINC000012322627
ZINC12322627
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