Vitas-M small molecule compound
11-(propan-2-yl)-3-(prop-2-en-1-ylsulfanyl)-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
STK539351
SMILES C=CCSc1nnc2n1cnc1c2sc2c1c1CCCCc1c(n2)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 C20H21N5S2 MW 395.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N5S2/c1-4-9-26-20-24-23-18-17-16(21-10-25(18)20)14-12-7-5-6-8-13(12)15(11(2)3)22-19(14)27-17/h4,10-11H,1,5-9H2,2-3H3InChIKey
GVABIOWFSKNMCA-UHFFFAOYSA-NSynonyms
385420-59-711(propan2yl)3(prop2en1ylsulfanyl)78910tetrahydro(124)triazolo(4316)pyrimido(4545)thieno(23c)isoquinoline
3(allylthio)11isopropyl78910tetrahydro(124)triazolo(4316)pyrimido(4545)thieno(23c)isoquinoline
385420597
CC(C)C1=C2CCCCC2=C3C4=C(C5=NN=C(N5C=N4)SCC=C)SC3=N1
InChI=1SC20H21N5S2c14926202423181716(211025(18)20)1412756813(12)15(11(2)3)2219(14)2717h41011H159H223H3
MFCD03286161
ZINC000013284492
ZINC13284492
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