Vitas-M small molecule compound
3-(1,3-benzodioxol-5-yl)-6-[5-(4-methoxyphenyl)-1,2-oxazol-3-yl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Catalog ID
STK635831
SMILES COc1ccc(cc1)c1onc(c1)c1nn2c(s1)nnc2c1ccc2c(c1)OCO2
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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 C20H13N5O4S MW 419.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H13N5O4S/c1-26-13-5-2-11(3-6-13)16-9-14(24-29-16)19-23-25-18(21-22-20(25)30-19)12-4-7-15-17(8-12)28-10-27-15/h2-9H,10H2,1H3InChIKey
ZJGQMJPOUAKDAP-UHFFFAOYSA-NSynonyms
1010908-63-01010908630
3(13benzodioxol5yl)6(5(4methoxyphenyl)12oxazol3yl)(124)triazolo(34b)(134)thiadiazole
3(3(13benzodioxol5yl)(124)triazolo(34b)(134)thiadiazol6yl)5(4methoxyphenyl)12oxazole
3(3(benzo(d)(13)dioxol5yl)(124)triazolo(34b)(134)thiadiazol6yl)5(4methoxyphenyl)isoxazole
COC1=CC=C(C=C1)C2=CC(=NO2)C3=NN4C(=NN=C4S3)C5=CC6=C(C=C5)OCO6
InChI=1SC20H13N5O4Sc126135211(3613)16914(242916)19232518(212220(25)3019)12471517(812)28102715h29H10H21H3
MFCD12200341
ZINC000012323149
ZINC12323149
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