Vitas-M small molecule compound

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

Catalog ID
STK831466
SMILES CC1CCc2c(C1)sc1c2c(=O)n(c2n1c(SCc1ccccc1)nn2)c1ccccc1

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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 C25H22N4OS2 MW 458.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22N4OS2/c1-16-12-13-19-20(14-16)32-23-21(19)22(30)28(18-10-6-3-7-11-18)24-26-27-25(29(23)24)31-15-17-8-4-2-5-9-17/h2-11,16H,12-15H2,1H3
InChIKey
FUDPDEGTWFTGDT-UHFFFAOYSA-N
Synonyms

1(benzylsulfanyl)8methyl4phenyl6789tetrahydro(1)benzothieno(32e)(124)triazolo(43a)pyrimidin5(4H)one
1(benzylthio)8methyl4phenyl6789tetrahydrobenzo(45)thieno(32e)(124)triazolo(43a)pyrimidin5(4H)one
CC1CCC2=C(C1)SC3=C2C(=O)N(C4=NN=C(N34)SCC5=CC=CC=C5)C6=CC=CC=C6
InChI=1SC25H22N4OS2c11612131920(1416)322321(19)22(30)28(18106371118)24262725(29(23)24)3115178425917h21116H1215H21H3
MFCD02234005
ZINC000001800147
ZINC000001800148

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Available files

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