Vitas-M small molecule compound
5-ethyl-3-(heptylsulfanyl)-10,10-dimethyl-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidine
Catalog ID
STK549575
SMILES CCCCCCCSc1nnc2n1c(CC)nc1c2c2CC(C)(C)OCc2s1
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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 C21H30N4OS2 MW 418.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H30N4OS2/c1-5-7-8-9-10-11-27-20-24-23-18-17-14-12-21(3,4)26-13-15(14)28-19(17)22-16(6-2)25(18)20/h5-13H2,1-4H3InChIKey
TXKCAQMCJBXPKA-UHFFFAOYSA-NSynonyms
799807-26-45ethyl3(heptylsulfanyl)1010dimethyl1011dihydro8Hpyrano(4345)thieno(32e)(124)triazolo(43c)pyrimidine
5ethyl3(heptylthio)1010dimethyl1011dihydro8Hpyrano(4345)thieno(32e)(124)triazolo(43c)pyrimidine
799807264
CCCCCCCSC1=NN=C2N1C(=NC3=C2C4=C(S3)COC(C4)(C)C)CC
InChI=1SC21H30N4OS2c157891011272024231817141221(34)261315(14)2819(17)2216(62)25(18)20h513H214H3
MFCD03679431
ZINC000002226106
ZINC2226106
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