Vitas-M small molecule compound
4-(heptylsulfanyl)-8,8-dimethyl-7,10-dihydro-8H-pyrano[3'',4'':5',6']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine
Catalog ID
STK723242
SMILES CCCCCCCSc1ncnc2c1sc1c2cc2c(n1)CC(OC2)(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 C21H27N3OS2 MW 401.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H27N3OS2/c1-4-5-6-7-8-9-26-20-18-17(22-13-23-20)15-10-14-12-25-21(2,3)11-16(14)24-19(15)27-18/h10,13H,4-9,11-12H2,1-3H3InChIKey
SDGAFFTYPKSIFD-UHFFFAOYSA-NSynonyms
4(heptylsulfanyl)88dimethyl710dihydro8Hpyrano(3456)pyrido(3245)thieno(32d)pyrimidine
4(heptylthio)88dimethyl810dihydro7Hpyrano(3456)pyrido(3245)thieno(32d)pyrimidine
CCCCCCCSC1=NC=NC2=C1SC3=NC4=C(COC(C4)(C)C)C=C23
InChI=1SC21H27N3OS2c145678926201817(22132320)151014122521(23)1116(14)2419(15)2718h1013H491112H213H3
MFCD02987147
ZINC000097951061
ZINC97951061
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