Vitas-M small molecule compound
3-(butylsulfanyl)-11-(2-methylpropyl)-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
STL226984
SMILES CCCCSc1nnc2n1cnc1c2sc2c1c1CCCCc1c(n2)CC(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 C22H27N5S2 MW 425.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H27N5S2/c1-4-5-10-28-22-26-25-20-19-18(23-12-27(20)22)17-15-9-7-6-8-14(15)16(11-13(2)3)24-21(17)29-19/h12-13H,4-11H2,1-3H3InChIKey
UFBKAUGAMGRWTR-UHFFFAOYSA-NSynonyms
371125-15-43(butylsulfanyl)11(2methylpropyl)78910tetrahydro(124)triazolo(4316)pyrimido(4545)thieno(23c)isoquinoline
3(butylthio)11isobutyl78910tetrahydro(124)triazolo(4316)pyrimido(4545)thieno(23c)isoquinoline
371125154
CCCCSC1=NN=C2N1C=NC3=C2SC4=NC(=C5CCCCC5=C34)CC(C)C
InChI=1SC22H27N5S2c1451028222625201918(231227(20)22)1715976814(15)16(1113(2)3)2421(17)2919h1213H411H213H3
MFCD03007931
ZINC000001813377
ZINC01813377
ZINC1813377
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