Vitas-M small molecule compound

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

Catalog ID
STK662494
SMILES OC(=O)c1ccc(cc1)CSc1nnc(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 C11H10N2O2S2 MW 266.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H10N2O2S2/c1-7-12-13-11(17-7)16-6-8-2-4-9(5-3-8)10(14)15/h2-5H,6H2,1H3,(H,14,15)
InChIKey
GZXGETYLQOEMGT-UHFFFAOYSA-N
Synonyms

4(((5methyl134thiadiazol2yl)sulfanyl)methyl)benzoicacid
4(((5METHYL134THIADIAZOL2YL)THIO)METHYL)BENZOICACID
4((5METHYL134THIADIAZOL2YL)SULFANYLMETHYL)BENZOICACID
4((5METHYL134THIADIAZOL2YLTHIO)METHYL)BENZOICACID
CC1=NN=C(S1)SCC2=CC=C(C=C2)C(=O)O
InChI=1SC11H10N2O2S2c17121311(177)1668249(538)10(14)15h25H6H21H3(H1415)
MFCD01829611
ZINC000000133720
ZINC133720

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Available files

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