Vitas-M small molecule compound
4-phenyl-1-(prop-2-en-1-ylsulfanyl)-6,7,8,9-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Catalog ID
STK831142
SMILES C=CCSc1nnc2n1c1sc3c(c1c(=O)n2c1ccccc1)CCCC3
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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/c1-2-12-26-20-22-21-19-23(13-8-4-3-5-9-13)17(25)16-14-10-6-7-11-15(14)27-18(16)24(19)20/h2-5,8-9H,1,6-7,10-12H2InChIKey
XIBCAKJMMBOEHB-UHFFFAOYSA-NSynonyms
312626-04-31(allylthio)4phenyl6789tetrahydrobenzo(45)thieno(32e)(124)triazolo(43a)pyrimidin5(4H)one
312626043
4phenyl1(prop2en1ylsulfanyl)6789tetrahydro(1)benzothieno(32e)(124)triazolo(43a)pyrimidin5(4H)one
C=CCSC1=NN=C2N1C3=C(C4=C(S3)CCCC4)C(=O)N2C5=CC=CC=C5
InChI=1SC20H18N4OS2c1212262022211923(138435913)17(25)161410671115(14)2718(16)24(19)20h2589H1671012H2
MFCD00698463
ZINC000002314963
ZINC02314963
ZINC2314963
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