Vitas-M small molecule compound
4-benzyl-8-tert-butyl-1-sulfanyl-6,7,8,9-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Catalog ID
STK804959
SMILES O=c1c2c3CCC(Cc3sc2n2c(n1Cc1ccccc1)nnc2S)C(C)(C)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 C22H24N4OS2 MW 424.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H24N4OS2/c1-22(2,3)14-9-10-15-16(11-14)29-19-17(15)18(27)25(12-13-7-5-4-6-8-13)20-23-24-21(28)26(19)20/h4-8,14H,9-12H2,1-3H3,(H,24,28)InChIKey
SHFAKUIMEINUHI-UHFFFAOYSA-NSynonyms
6000-33-54benzyl8(tertbutyl)1mercapto6789tetrahydrobenzo(45)thieno(32e)(124)triazolo(43a)pyrimidin5(4H)one
4benzyl8tertbutyl1sulfanyl6789tetrahydro(1)benzothieno(32e)(124)triazolo(43a)pyrimidin5(4H)one
6000335
CC(C)(C)C1CCC2=C(C1)SC3=C2C(=O)N(C4=NNC(=S)N34)CC5=CC=CC=C5
InChI=1SC22H24N4OS2c122(23)149101516(1114)291917(15)18(27)25(12137546813)20232421(28)26(19)20h4814H912H213H3(H2428)
MFCD01897850
ZINC000002276848
ZINC000002276849
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