Vitas-M small molecule compound
4-(4-methylphenyl)-1-(methylsulfanyl)-6,7,8,9-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Catalog ID
STK830834
SMILES CSc1nnc2n1c1sc3c(c1c(=O)n2c1ccc(cc1)C)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 C19H18N4OS2 MW 382.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18N4OS2/c1-11-7-9-12(10-8-11)22-16(24)15-13-5-3-4-6-14(13)26-17(15)23-18(22)20-21-19(23)25-2/h7-10H,3-6H2,1-2H3InChIKey
NVHZUDWRKRWGFW-UHFFFAOYSA-NSynonyms
372173-59-61(methylthio)4(ptolyl)6789tetrahydrobenzo(45)thieno(32e)(124)triazolo(43a)pyrimidin5(4H)one
372173596
4(4methylphenyl)1(methylsulfanyl)6789tetrahydro(1)benzothieno(32e)(124)triazolo(43a)pyrimidin5(4H)one
CC1=CC=C(C=C1)N2C(=O)C3=C(N4C2=NN=C4SC)SC5=C3CCCC5
InChI=1SC19H18N4OS2c1117912(10811)2216(24)1513534614(13)2617(15)2318(22)202119(23)252h710H36H212H3
MFCD01879478
ZINC000001204989
ZINC01204989
ZINC1204989
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