Vitas-M small molecule compound
1-(4-{3-[3-(furan-2-yl)-1H-pyrazol-5-yl]-5-thioxo-1,5-dihydro-4H-1,2,4-triazol-4-yl}phenyl)ethanone
Catalog ID
STL336981
SMILES CC(=O)c1ccc(cc1)n1c(=S)[nH]nc1c1[nH]nc(c1)c1ccco1
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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 C17H13N5O2S MW 351.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H13N5O2S/c1-10(23)11-4-6-12(7-5-11)22-16(20-21-17(22)25)14-9-13(18-19-14)15-3-2-8-24-15/h2-9H,1H3,(H,18,19)(H,21,25)InChIKey
YIVILBJKJXYRIP-UHFFFAOYSA-NSynonyms
955899-95-31(4(3(3(furan2yl)1Hpyrazol5yl)5thioxo15dihydro4H124triazol4yl)phenyl)ethanone
1(4(3(5(FURAN2YL)1HPYRAZOL3YL)5SULFANYLIDENE1H124TRIAZOL4YL)PHENYL)ETHANONE
1(4(3(5FURAN2YL2HPYRAZOL3YL)5MERCAPTO(124)TRIAZOL4YL)PHENYL)ETHANONE
CC(=O)C1=CC=C(C=C1)N2C(=NNC2=S)C3=NNC(=C3)C4=CC=CO4
CC(=O)c1ccc(cc1)n1c(=S)(nH)nc1c1(nH)nc(c1)c1ccco1
InChI=1SC17H13N5O2Sc110(23)114612(7511)2216(202117(22)25)14913(181914)153282415h29H1H3(H1819)(H2125)
MFCD07794162
ZINC000018189276
ZINC18189276
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