Vitas-M small molecule compound
9-tert-butyl-2-(4-chloro-1,5-dimethyl-1H-pyrazol-3-yl)-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Catalog ID
STK308742
SMILES Cn1nc(c(c1C)Cl)c1nn2c(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 C20H23ClN6S MW 414.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H23ClN6S/c1-10-15(21)16(24-26(10)5)17-23-18-14-12-7-6-11(20(2,3)4)8-13(12)28-19(14)22-9-27(18)25-17/h9,11H,6-8H2,1-5H3InChIKey
JPPLJSWLAWDNHJ-UHFFFAOYSA-NSynonyms
1005648-78-11005648781
9tertbutyl2(4chloro15dimethyl1Hpyrazol3yl)891011tetrahydro(1)benzothieno(32e)(124)triazolo(15c)pyrimidine
CC1=C(C(=NN1C)C2=NN3C=NC4=C(C3=N2)C5=C(S4)CC(CC5)C(C)(C)C)Cl
InChI=1SC20H23ClN6Sc11015(21)16(2426(10)5)17231814127611(20(23)4)813(12)2819(14)22927(18)2517h911H68H215H3
MFCD04132620
ZINC000002798085
ZINC000002798086
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