Vitas-M small molecule compound
7-methoxy-2-(4-phenyl-1,3-thiazol-2-yl)-3-(trifluoromethyl)-3,3a,4,5-tetrahydro-2H-benzo[g]indazol-3-ol
Catalog ID
STL448524
SMILES COc1ccc2c(c1)CCC1C2=NN(C1(O)C(F)(F)F)c1scc(n1)c1ccccc1
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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 C22H18F3N3O2S MW 445.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18F3N3O2S/c1-30-15-8-9-16-14(11-15)7-10-17-19(16)27-28(21(17,29)22(23,24)25)20-26-18(12-31-20)13-5-3-2-4-6-13/h2-6,8-9,11-12,17,29H,7,10H2,1H3InChIKey
WHSPSQBXFFKVHF-UHFFFAOYSA-NSynonyms
7methoxy2(4phenyl13thiazol2yl)3(trifluoromethyl)33a45tetrahydro2Hbenzo(g)indazol3ol
7methoxy2(4phenyl13thiazol2yl)3(trifluoromethyl)45dihydro3aHbenzo(g)indazol3ol
COC1=CC2=C(C=C1)C3=NN(C(C3CC2)(C(F)(F)F)O)C4=NC(=CS4)C5=CC=CC=C5
InChI=1SC22H18F3N3O2Sc13015891614(1115)7101719(16)2728(21(1729)22(2324)25)202618(123120)135324613h268911121729H710H21H3
MFCD08060402
ZINC000016957587
ZINC000016957593
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