Vitas-M small molecule compound
9-ethyl-2-{2-[5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]ethyl}-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Catalog ID
STK306356
SMILES CCC1CCc2c(C1)sc1c2c2nc(nn2cn1)CCn1nc(cc1C)C(F)(F)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 C20H21F3N6S MW 434.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21F3N6S/c1-3-12-4-5-13-14(9-12)30-19-17(13)18-25-16(27-29(18)10-24-19)6-7-28-11(2)8-15(26-28)20(21,22)23/h8,10,12H,3-7,9H2,1-2H3InChIKey
QVCJCRZNNQWFIF-UHFFFAOYSA-NSynonyms
1005565-73-01005565730
9ethyl2(2(5methyl3(trifluoromethyl)1Hpyrazol1yl)ethyl)891011tetrahydro(1)benzothieno(32e)(124)triazolo(15c)pyrimidine
CCC1CCC2=C(C1)SC3=C2C4=NC(=NN4C=N3)CCN5C(=CC(=N5)C(F)(F)F)C
InChI=1SC20H21F3N6Sc1312451314(912)301917(13)182516(2729(18)102419)672811(2)815(2628)20(2122)23h81012H379H212H3
MFCD04053513
ZINC000002790072
ZINC000002790073
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