Vitas-M small molecule compound
2-[1-(difluoromethyl)-1H-pyrazol-3-yl]-9-(2-methylbutan-2-yl)-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Catalog ID
STK308747
SMILES CCC(C1CCc2c(C1)sc1c2c2nc(nn2cn1)c1ccn(n1)C(F)F)(C)C
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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 C20H22F2N6S MW 416.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22F2N6S/c1-4-20(2,3)11-5-6-12-14(9-11)29-18-15(12)17-24-16(26-28(17)10-23-18)13-7-8-27(25-13)19(21)22/h7-8,10-11,19H,4-6,9H2,1-3H3InChIKey
WZIHXGRAXRIZRS-UHFFFAOYSA-NSynonyms
1005708-40-61005708406
2(1(difluoromethyl)1Hpyrazol3yl)9(2methylbutan2yl)891011tetrahydro(1)benzothieno(32e)(124)triazolo(15c)pyrimidine
CCC(C)(C)C1CCC2=C(C1)SC3=C2C4=NC(=NN4C=N3)C5=NN(C=C5)C(F)F
InChI=1SC20H22F2N6Sc1420(23)11561214(911)291815(12)172416(2628(17)102318)137827(2513)19(21)22h78101119H469H213H3
MFCD04051185
ZINC000002798105
ZINC000002798106
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