Vitas-M small molecule compound
8-[(3-methylbutyl)sulfanyl]-5-(propan-2-yl)-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinoline
Catalog ID
STK721297
SMILES CC(CCSc1ncnc2c1sc1c2c2CCCCc2c(n1)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 C21H27N3S2 MW 385.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H27N3S2/c1-12(2)9-10-25-21-19-18(22-11-23-21)16-14-7-5-6-8-15(14)17(13(3)4)24-20(16)26-19/h11-13H,5-10H2,1-4H3InChIKey
VRKBDNRJWLIOGG-UHFFFAOYSA-NSynonyms
8((3methylbutyl)sulfanyl)5(propan2yl)1234tetrahydropyrimido(4545)thieno(23c)isoquinoline
8(isopentylthio)5isopropyl1234tetrahydropyrimido(4545)thieno(23c)isoquinoline
CC(C)CCSC1=NC=NC2=C1SC3=NC(=C4CCCCC4=C23)C(C)C
InChI=1SC21H27N3S2c112(2)91025211918(22112321)1614756815(14)17(13(3)4)2420(16)2619h1113H510H214H3
MFCD02234308
ZINC000002292446
ZINC02292446
ZINC2292446
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