Vitas-M small molecule compound
4-(3-methylphenyl)-1-(prop-2-en-1-ylsulfanyl)-7,8-dihydro-6H-cyclopenta[4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Catalog ID
STK720970
SMILES C=CCSc1nnc2n1c1sc3c(c1c(=O)n2c1cccc(c1)C)CCC3
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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 C20H18N4OS2 MW 394.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18N4OS2/c1-3-10-26-20-22-21-19-23(13-7-4-6-12(2)11-13)17(25)16-14-8-5-9-15(14)27-18(16)24(19)20/h3-4,6-7,11H,1,5,8-10H2,2H3InChIKey
RBZLINLWDBOHOV-UHFFFAOYSA-NSynonyms
384354-07-81(allylthio)4(mtolyl)78dihydro4Hcyclopenta(45)thieno(32e)(124)triazolo(43a)pyrimidin5(6H)one
384354078
4(3methylphenyl)1(prop2en1ylsulfanyl)78dihydro6Hcyclopenta(45)thieno(32e)(124)triazolo(43a)pyrimidin5(4H)one
CC1=CC(=CC=C1)N2C(=O)C3=C(N4C2=NN=C4SCC=C)SC5=C3CCC5
InChI=1SC20H18N4OS2c1310262022211923(1374612(2)1113)17(25)161485915(14)2718(16)24(19)20h346711H15810H22H3
MFCD03285401
ZINC000001806646
ZINC01806646
ZINC1806646
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