Vitas-M small molecule compound
5-({[5-(4-chlorophenyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-3-(2,5-dimethoxyphenyl)-1,2,4-oxadiazole
Catalog ID
STL415601
SMILES COc1ccc(cc1c1noc(n1)CSc1nnc(n1CC)c1ccc(cc1)Cl)OC
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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 C21H20ClN5O3S MW 457.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20ClN5O3S/c1-4-27-20(13-5-7-14(22)8-6-13)24-25-21(27)31-12-18-23-19(26-30-18)16-11-15(28-2)9-10-17(16)29-3/h5-11H,4,12H2,1-3H3InChIKey
CRCKZAOBFSLHLJ-UHFFFAOYSA-NSynonyms
5(((5(4chlorophenyl)4ethyl4H124triazol3yl)sulfanyl)methyl)3(25dimethoxyphenyl)124oxadiazole
5((5(4chlorophenyl)4ethyl124triazol3yl)sulfanylmethyl)3(25dimethoxyphenyl)124oxadiazole
CCN1C(=NN=C1SCC2=NC(=NO2)C3=C(C=CC(=C3)OC)OC)C4=CC=C(C=C4)Cl
InChI=1SC21H20ClN5O3Sc142720(135714(22)8613)242521(27)3112182319(263018)161115(282)91017(16)293h511H412H213H3
MFCD14812450
ZINC000020867916
ZINC20867916
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