Vitas-M small molecule compound
8-(butylsulfanyl)-5-(2-methylpropyl)-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinoline
Catalog ID
STK721372
SMILES CCCCSc1ncnc2c1sc1c2c2CCCCc2c(n1)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 C21H27N3S2 MW 385.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H27N3S2/c1-4-5-10-25-21-19-18(22-12-23-21)17-15-9-7-6-8-14(15)16(11-13(2)3)24-20(17)26-19/h12-13H,4-11H2,1-3H3InChIKey
QSSDJOFZBKIENW-UHFFFAOYSA-NSynonyms
385390-97-6385390976
8(butylsulfanyl)5(2methylpropyl)1234tetrahydropyrimido(4545)thieno(23c)isoquinoline
8(butylthio)5isobutyl1234tetrahydropyrimido(4545)thieno(23c)isoquinoline
CCCCSC1=NC=NC2=C1SC3=NC(=C4CCCCC4=C23)CC(C)C
InChI=1SC21H27N3S2c1451025211918(22122321)1715976814(15)16(1113(2)3)2420(17)2619h1213H411H213H3
MFCD03285706
ZINC000013284488
ZINC13284488
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