Vitas-M small molecule compound
9-tert-butyl-2-[(3,5-dimethyl-1H-pyrazol-1-yl)methyl]-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Catalog ID
STK308837
SMILES Cc1nn(c(c1)C)Cc1nn2c(n1)c1c(nc2)sc2c1CCC(C2)C(C)(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 C21H26N6S MW 394.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H26N6S/c1-12-8-13(2)26(24-12)10-17-23-19-18-15-7-6-14(21(3,4)5)9-16(15)28-20(18)22-11-27(19)25-17/h8,11,14H,6-7,9-10H2,1-5H3InChIKey
UHKRRWQYHLNHLI-UHFFFAOYSA-NSynonyms
1005555-08-71005555087
9tertbutyl2((35dimethyl1Hpyrazol1yl)methyl)891011tetrahydro(1)benzothieno(32e)(124)triazolo(15c)pyrimidine
CC1=CC(=NN1CC2=NN3C=NC4=C(C3=N2)C5=C(S4)CC(CC5)C(C)(C)C)C
InChI=1SC21H26N6Sc112813(2)26(2412)1017231918157614(21(34)5)916(15)2820(18)221127(19)2517h81114H67910H215H3
MFCD04132792
ZINC000002798375
ZINC000002798376
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