Vitas-M small molecule compound
2-{[3-(difluoromethyl)-5-methyl-1H-pyrazol-1-yl]methyl}-9-methyl-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Catalog ID
STK306243
SMILES CC1CCc2c(C1)sc1c2c2nc(nn2cn1)Cn1nc(cc1C)C(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 C18H18F2N6S MW 388.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18F2N6S/c1-9-3-4-11-13(5-9)27-18-15(11)17-22-14(24-26(17)8-21-18)7-25-10(2)6-12(23-25)16(19)20/h6,8-9,16H,3-5,7H2,1-2H3InChIKey
LNIUARIYLICOGP-UHFFFAOYSA-NSynonyms
1005564-89-51005564895
2((3(difluoromethyl)5methyl1Hpyrazol1yl)methyl)9methyl891011tetrahydro(1)benzothieno(32e)(124)triazolo(15c)pyrimidine
CC1CCC2=C(C1)SC3=C2C4=NC(=NN4C=N3)CN5C(=CC(=N5)C(F)F)C
InChI=1SC18H18F2N6Sc19341113(59)271815(11)172214(2426(17)82118)72510(2)612(2325)16(19)20h68916H357H212H3
MFCD04129704
ZINC000002789649
ZINC000002789650
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