Vitas-M small molecule compound
2-(1,3-benzothiazol-2-yl)-5-methyl-3-(trifluoromethyl)-3,3a,4,5,6,7-hexahydro-2H-indazol-3-ol
Catalog ID
STL441688
SMILES CC1CCC2=NN(C(C2C1)(O)C(F)(F)F)c1nc2c(s1)cccc2
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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 C16H16F3N3OS MW 355.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16F3N3OS/c1-9-6-7-11-10(8-9)15(23,16(17,18)19)22(21-11)14-20-12-4-2-3-5-13(12)24-14/h2-5,9-10,23H,6-8H2,1H3InChIKey
BAGPJGSPOHTGMQ-UHFFFAOYSA-NSynonyms
2(13benzothiazol2yl)5methyl3(trifluoromethyl)33a4567hexahydro2Hindazol3ol
2(13benzothiazol2yl)5methyl3(trifluoromethyl)4567tetrahydro3aHindazol3ol
CC1CCC2=NN(C(C2C1)(C(F)(F)F)O)C3=NC4=CC=CC=C4S3
InChI=1SC16H16F3N3OSc19671110(89)15(2316(1718)19)22(2111)142012423513(12)2414h2591023H68H21H3
MFCD08060374
ZINC000005275007
ZINC000248327961
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