Vitas-M small molecule compound

2-{[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]methyl}benzonitrile

Catalog ID
STK147409
SMILES N#Cc1ccccc1CSc1nnc(s1)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 C11H9N3S2 MW 247.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H9N3S2/c1-8-13-14-11(16-8)15-7-10-5-3-2-4-9(10)6-12/h2-5H,7H2,1H3
InChIKey
IBYAJBDRWDJYFL-UHFFFAOYSA-N
Synonyms
693241-56-4
2(((5METHYL134THIADIAZOL2YL)SULFANYL)METHYL)BENZONITRILE
2((5METHYL134THIADIAZOL2YL)SULFANYLMETHYL)BENZONITRILE
2(5METHYL(134)THIADIAZOL2YLSULFANYLMETHYL)BENZONITRILE
693241564
CC1=NN=C(S1)SCC2=CC=CC=C2C#N
InChI=1SC11H9N3S2c18131411(168)1571053249(10)612h25H7H21H3
MFCD03876492
ZINC000000468546
ZINC00468546
ZINC468546

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Available files

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