Vitas-M small molecule compound
8-(hexylsulfanyl)-5-propyl-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinoline
Catalog ID
STK531374
SMILES CCCCCCSc1ncnc2c1sc1c2c2CCCCc2c(n1)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 C22H29N3S2 MW 399.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H29N3S2/c1-3-5-6-9-13-26-22-20-19(23-14-24-22)18-16-12-8-7-11-15(16)17(10-4-2)25-21(18)27-20/h14H,3-13H2,1-2H3InChIKey
XFPSCFKAOHMDTL-UHFFFAOYSA-NSynonyms
8(hexylsulfanyl)5propyl1234tetrahydropyrimido(4545)thieno(23c)isoquinoline
8(hexylthio)5propyl1234tetrahydropyrimido(4545)thieno(23c)isoquinoline
CCCCCCSC1=NC=NC2=C1SC3=NC(=C4CCCCC4=C23)CCC
InChI=1SC22H29N3S2c135691326222019(23142422)181612871115(16)17(1042)2521(18)2720h14H313H212H3
MFCD02239821
ZINC000001762334
ZINC01762334
ZINC1762334
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