Vitas-M small molecule compound

5-[(3-phenylprop-2-yn-1-yl)sulfanyl]-1,3,4-thiadiazole-2-thiol

Catalog ID
STL149552
SMILES Sc1nnc(s1)SCC#Cc1ccccc1

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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 C11H8N2S3 MW 264.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H8N2S3/c14-10-12-13-11(16-10)15-8-4-7-9-5-2-1-3-6-9/h1-3,5-6H,8H2,(H,12,14)
InChIKey
LNOVZJFBUSHQLL-UHFFFAOYSA-N
Synonyms
313272-39-8
313272398
5((3PHENYLPROP2YN1YL)SULFANYL)134THIADIAZOLE2(3H)THIONE
5((3phenylprop2yn1yl)sulfanyl)134thiadiazole2thiol
5(3PHENYLPROP2YNYLSULFANYL)3H134THIADIAZOLE2THIONE
5(3PHENYLPROP2YNYLTHIO)134THIADIAZOLINE2THIONE
C1=CC=C(C=C1)C#CCSC2=NNC(=S)S2
InChI=1SC11H8N2S3c1410121311(1610)158479521369h1356H8H2(H1214)
MFCD03813190
ZINC000002313385
ZINC2313385

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Available files

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