Vitas-M small molecule compound

8-tert-butyl-4-methyl-1-[(3-methylbutyl)sulfanyl]-6,7,8,9-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one

Catalog ID
STK722748
SMILES CC(CCSc1nnc2n1c1sc3c(c1c(=O)n2C)CCC(C3)C(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 C21H30N4OS2 MW 418.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H30N4OS2/c1-12(2)9-10-27-20-23-22-19-24(6)17(26)16-14-8-7-13(21(3,4)5)11-15(14)28-18(16)25(19)20/h12-13H,7-11H2,1-6H3
InChIKey
UHLUGDTXKZWCAC-UHFFFAOYSA-N
Synonyms

8(tertbutyl)1(isopentylthio)4methyl6789tetrahydrobenzo(45)thieno(32e)(124)triazolo(43a)pyrimidin5(4H)one
8tertbutyl4methyl1((3methylbutyl)sulfanyl)6789tetrahydro(1)benzothieno(32e)(124)triazolo(43a)pyrimidin5(4H)one
CC(C)CCSC1=NN=C2N1C3=C(C4=C(S3)CC(CC4)C(C)(C)C)C(=O)N2C
InChI=1SC21H30N4OS2c112(2)910272023221924(6)17(26)16148713(21(34)5)1115(14)2818(16)25(19)20h1213H711H216H3
MFCD02240849
ZINC000001837628
ZINC000001837629

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Available files

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