Vitas-M small molecule compound
1-(4-{3-sulfanyl-5-[3-(thiophen-2-yl)-1H-pyrazol-5-yl]-4H-1,2,4-triazol-4-yl}phenyl)ethanone
Catalog ID
STK549714
SMILES CC(=O)c1ccc(cc1)n1c(S)nnc1c1[nH]nc(c1)c1cccs1
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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 C17H13N5OS2 MW 367.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H13N5OS2/c1-10(23)11-4-6-12(7-5-11)22-16(20-21-17(22)24)14-9-13(18-19-14)15-3-2-8-25-15/h2-9H,1H3,(H,18,19)(H,21,24)InChIKey
OFANAONBRYPLSG-UHFFFAOYSA-NSynonyms
955890-82-11(4(3mercapto5(3(thiophen2yl)1Hpyrazol5yl)4H124triazol4yl)phenyl)ethanone
1(4(3sulfanyl5(3(thiophen2yl)1Hpyrazol5yl)4H124triazol4yl)phenyl)ethanone
1(4(5SULFANYLIDENE3(5THIOPHEN2YL1HPYRAZOL3YL)1H124TRIAZOL4YL)PHENYL)ETHANONE
955890821
CC(=O)C1=CC=C(C=C1)N2C(=NNC2=S)C3=NNC(=C3)C4=CC=CS4
CC(=O)c1ccc(cc1)n1c(S)nnc1c1(nH)nc(c1)c1cccs1
InChI=1SC17H13N5OS2c110(23)114612(7511)2216(202117(22)24)14913(181914)153282515h29H1H3(H1819)(H2124)
MFCD03672909
ZINC000005789540
ZINC5789540
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