Vitas-M small molecule compound
10-butyl-3-(prop-2-en-1-ylsulfanyl)-7,8,9,11a-tetrahydro-6bH-cyclopenta[4',5']pyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[4,3-c]pyrimidine
Catalog ID
STK553313
SMILES CCCCC1=NC2Sc3c(C2C2=C1CCC2)ncn1c3nnc1SCC=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 C20H23N5S2 MW 397.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H23N5S2/c1-3-5-9-14-12-7-6-8-13(12)15-16-17(27-19(15)22-14)18-23-24-20(26-10-4-2)25(18)11-21-16/h4,11,15,19H,2-3,5-10H2,1H3InChIKey
RTFJTRXIXUBGLF-UHFFFAOYSA-NSynonyms
10butyl3(prop2en1ylsulfanyl)78911atetrahydro6bHcyclopenta(45)pyrido(3245)thieno(23e)(124)triazolo(43c)pyrimidine
CCCCC1=NC2C(C3=C1CCC3)C4=C(S2)C5=NN=C(N5C=N4)SCC=C
InChI=1SC20H23N5S2c1359141276813(12)151617(2719(15)2214)18232420(261042)25(18)112116h4111519H23510H21H3
MFCD03681126
ZINC000006309807
ZINC000006309929
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