Vitas-M small molecule compound
4-benzyl-8-tert-butyl-1-(ethylsulfanyl)-6,7,8,9-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Catalog ID
STK804961
SMILES CCSc1nnc2n1c1sc3c(c1c(=O)n2Cc1ccccc1)CCC(C3)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 C24H28N4OS2 MW 452.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H28N4OS2/c1-5-30-23-26-25-22-27(14-15-9-7-6-8-10-15)20(29)19-17-12-11-16(24(2,3)4)13-18(17)31-21(19)28(22)23/h6-10,16H,5,11-14H2,1-4H3InChIKey
AWRRAGGNTJYVNV-UHFFFAOYSA-NSynonyms
351338-53-9351338539
4benzyl8(tertbutyl)1(ethylthio)6789tetrahydrobenzo(45)thieno(32e)(124)triazolo(43a)pyrimidin5(4H)one
4benzyl8tertbutyl1(ethylsulfanyl)6789tetrahydro(1)benzothieno(32e)(124)triazolo(43a)pyrimidin5(4H)one
CCSC1=NN=C2N1C3=C(C4=C(S3)CC(CC4)C(C)(C)C)C(=O)N2CC5=CC=CC=C5
InChI=1SC24H28N4OS2c15302326252227(141597681015)20(29)1917121116(24(23)4)1318(17)3121(19)28(22)23h61016H51114H214H3
MFCD01897861
ZINC000002280175
ZINC000002280176
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