Vitas-M small molecule compound

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

Catalog ID
STK134399
SMILES OC(=O)c1cccc(c1)CSc1nnc(o1)c1ccco1

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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 C14H10N2O4S MW 302.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H10N2O4S/c17-13(18)10-4-1-3-9(7-10)8-21-14-16-15-12(20-14)11-5-2-6-19-11/h1-7H,8H2,(H,17,18)
InChIKey
GTKOLPYHRMDQHN-UHFFFAOYSA-N
Synonyms

3(((5(FURAN2YL)134OXADIAZOL2YL)SULFANYL)METHYL)BENZOICACID
3((5(2FURYL)134OXADIAZOL2YLTHIO)METHYL)BENZOICACID
3((5(FURAN2YL)134OXADIAZOL2YL)SULFANYLMETHYL)BENZOICACID
3(5FURAN2YL(134)OXADIAZOL2YLSULFANYLMETHYL)BENZOICACID
C1=CC(=CC(=C1)CSC2=NN=C(O2)C3=CC=CO3)C(=O)O
InChI=1SC14H10N2O4Sc1713(18)104139(710)82114161512(2014)115261911h17H8H2(H1718)
MFCD04518672
ZINC000000574181
ZINC574181

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Available files

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