Vitas-M small molecule compound
3-(butylsulfanyl)-11-propyl-7,8,9,10-tetrahydro[1,2,4]triazolo[4'',3'':1',6']pyrimido[4',5':4,5]thieno[2,3-c]isoquinoline
Catalog ID
STK551252
SMILES CCCCSc1nnc2n1cnc1c2sc2c1c1CCCCc1c(n2)CCC
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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 C21H25N5S2 MW 411.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25N5S2/c1-3-5-11-27-21-25-24-19-18-17(22-12-26(19)21)16-14-10-7-6-9-13(14)15(8-4-2)23-20(16)28-18/h12H,3-11H2,1-2H3InChIKey
WTXGSNWNFPGZNZ-UHFFFAOYSA-NSynonyms
799832-32-93(butylsulfanyl)11propyl78910tetrahydro(124)triazolo(4316)pyrimido(4545)thieno(23c)isoquinoline
3(butylthio)11propyl78910tetrahydro(124)triazolo(4316)pyrimido(4545)thieno(23c)isoquinoline
799832329
CCCCSC1=NN=C2N1C=NC3=C2SC4=NC(=C5CCCCC5=C34)CCC
InChI=1SC21H25N5S2c1351127212524191817(221226(19)21)16141076913(14)15(842)2320(16)2818h12H311H212H3
MFCD03684537
ZINC000002246128
ZINC02246128
ZINC2246128
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Check stock on Vitas-MAvailable files
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