Vitas-M small molecule compound
3-{[3-(2,3-difluorophenyl)-5-thioxo-1,5-dihydro-4H-1,2,4-triazol-4-yl]methyl}benzoic acid
Catalog ID
STK640586
SMILES OC(=O)c1cccc(c1)Cn1c(=S)[nH]nc1c1cccc(c1F)F
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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 C16H11F2N3O2S MW 347.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H11F2N3O2S/c17-12-6-2-5-11(13(12)18)14-19-20-16(24)21(14)8-9-3-1-4-10(7-9)15(22)23/h1-7H,8H2,(H,20,24)(H,22,23)InChIKey
GXOAMAQYMXKQMB-UHFFFAOYSA-NSynonyms
1010929-70-01010929700
MFCD18162388
OC(=O)c1cccc(c1)Cn1c(=S)(nH)nc1c1cccc(c1F)F
ZINC000012321068
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