Vitas-M small molecule compound

2-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]-1-(3,4-dihydroisoquinolin-2(1H)-yl)ethanone

Catalog ID
STK100278
SMILES O=C(N1CCc2c(C1)cccc2)CSc1nnc(s1)N

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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 C13H14N4OS2 MW 306.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H14N4OS2/c14-12-15-16-13(20-12)19-8-11(18)17-6-5-9-3-1-2-4-10(9)7-17/h1-4H,5-8H2,(H2,14,15)
InChIKey
WGJSANPUQGAPAB-UHFFFAOYSA-N
Synonyms
352660-29-8
2((5AMINO134THIADIAZOL2YL)SULFANYL)1(34DIHYDRO1HISOQUINOLIN2YL)ETHANONE
2((5AMINO134THIADIAZOL2YL)SULFANYL)1(34DIHYDROISOQUINOLIN2(1H)YL)ETHANONE
2((5amino134thiadiazol2yl)thio)1(34dihydroisoquinolin2(1H)yl)ethanone
352660298
C1CN(CC2=CC=CC=C21)C(=O)CSC3=NN=C(S3)N
InChI=1SC13H14N4OS2c1412151613(2012)19811(18)17659312410(9)717h14H58H2(H21415)
MFCD01947914
ZINC000000103744
ZINC00103744
ZINC103744

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.