Vitas-M small molecule compound
1-[2-(1,3-benzothiazol-2-yl)-2,3,3a,4-tetrahydrochromeno[4,3-c]pyrazol-3-yl]-2,2,2-trifluoroethanone
Catalog ID
STL441754
SMILES O=C(C(F)(F)F)C1N(N=C2C1COc1c2cccc1)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 C19H12F3N3O2S MW 403.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H12F3N3O2S/c20-19(21,22)17(26)16-11-9-27-13-7-3-1-5-10(13)15(11)24-25(16)18-23-12-6-2-4-8-14(12)28-18/h1-8,11,16H,9H2InChIKey
WYRHRWCFLBUOHU-UHFFFAOYSA-NSynonyms
1(2(13benzothiazol2yl)233a4tetrahydrochromeno(43c)pyrazol3yl)222trifluoroethanone
1(2(13benzothiazol2yl)3a4dihydro3Hchromeno(43c)pyrazol3yl)222trifluoroethanone
C1C2C(N(N=C2C3=CC=CC=C3O1)C4=NC5=CC=CC=C5S4)C(=O)C(F)(F)F
InChI=1SC19H12F3N3O2Sc2019(2122)17(26)161192713731510(13)15(11)2425(16)182312624814(12)2818h181116H9H2
MFCD07774016
ZINC000005274844
ZINC000005274847
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