Vitas-M small molecule compound
12-ethyl-12-methyl-3,7-bis(prop-2-en-1-ylsulfanyl)-12,13-dihydro-10H-pyrano[4',3':4,5]thieno[3,2-e]bis[1,2,4]triazolo[4,3-a:4',3'-c]pyrimidine
Catalog ID
STL335812
SMILES C=CCSc1nnc2n1c1nnc(n1c1c2c2CC(C)(CC)OCc2s1)SCC=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 C20H22N6OS3 MW 458.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22N6OS3/c1-5-8-28-18-23-21-15-14-12-10-20(4,7-3)27-11-13(12)30-16(14)26-17(25(15)18)22-24-19(26)29-9-6-2/h5-6H,1-2,7-11H2,3-4H3InChIKey
CLPLPRCMXCQSHF-UHFFFAOYSA-NSynonyms
500104-96-112ethyl12methyl37bis(prop2en1ylsulfanyl)1213dihydro10Hpyrano(4345)thieno(32e)bis(124)triazolo(43a43c)pyrimidine
37bis(allylthio)12ethyl12methyl1213dihydro10Hpyrano(4345)thieno(32e)bis((124)triazolo)(43a43c)pyrimidine
500104961
CCC1(CC2=C(CO1)SC3=C2C4=NN=C(N4C5=NN=C(N35)SCC=C)SCC=C)C
InChI=1SC20H22N6OS3c158281823211514121020(473)271113(12)3016(14)2617(25(15)18)222419(26)29962h56H12711H234H3
MFCD03304074
ZINC000002357650
ZINC000002357652
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