Vitas-M small molecule compound
3-[({5-[(4-methoxyphenoxy)methyl]-1,3,4-oxadiazol-2-yl}sulfanyl)methyl]benzoic acid
Catalog ID
STL417750
SMILES COc1ccc(cc1)OCc1nnc(o1)SCc1cccc(c1)C(=O)O
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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 C18H16N2O5S MW 372.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16N2O5S/c1-23-14-5-7-15(8-6-14)24-10-16-19-20-18(25-16)26-11-12-3-2-4-13(9-12)17(21)22/h2-9H,10-11H2,1H3,(H,21,22)InChIKey
JYKRPNKMXCXNBD-UHFFFAOYSA-NSynonyms
3(((5((4methoxyphenoxy)methyl)134oxadiazol2yl)sulfanyl)methyl)benzoicacid
3((5((4METHOXYPHENOXY)METHYL)134OXADIAZOL2YL)SULFANYLMETHYL)BENZOICACID
COC1=CC=C(C=C1)OCC2=NN=C(O2)SCC3=CC=CC(=C3)C(=O)O
InChI=1SC18H16N2O5Sc123145715(8614)241016192018(2516)26111232413(912)17(21)22h29H1011H21H3(H2122)
MFCD07397722
ZINC000004943103
ZINC4943103
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