Vitas-M small molecule compound
8-(hexylsulfanyl)-2,2,5-trimethyl-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine
Catalog ID
STK539531
SMILES CCCCCCSc1ncnc2c1sc1c2c2CC(C)(C)OCc2c(n1)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 C21H27N3OS2 MW 401.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H27N3OS2/c1-5-6-7-8-9-26-20-18-17(22-12-23-20)16-14-10-21(3,4)25-11-15(14)13(2)24-19(16)27-18/h12H,5-11H2,1-4H3InChIKey
XEHLOWNVCGZGDX-UHFFFAOYSA-NSynonyms
672277-41-7672277417
8(hexylsulfanyl)225trimethyl14dihydro2Hpyrano(4345)pyrido(3245)thieno(32d)pyrimidine
8(hexylthio)225trimethyl24dihydro1Hpyrano(4345)pyrido(3245)thieno(32d)pyrimidine
CCCCCCSC1=NC=NC2=C1SC3=NC(=C4COC(CC4=C23)(C)C)C
InChI=1SC21H27N3OS2c15678926201817(22122320)16141021(34)251115(14)13(2)2419(16)2718h12H511H214H3
ZINC000013284486
ZINC13284486
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