Vitas-M small molecule compound
5-({[5-(4-chlorophenyl)-4-propyl-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-3-(2-ethoxyphenyl)-1,2,4-oxadiazole
Catalog ID
STL415574
SMILES CCOc1ccccc1c1noc(n1)CSc1nnc(n1CCC)c1ccc(cc1)Cl
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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 C22H22ClN5O2S MW 455.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22ClN5O2S/c1-3-13-28-21(15-9-11-16(23)12-10-15)25-26-22(28)31-14-19-24-20(27-30-19)17-7-5-6-8-18(17)29-4-2/h5-12H,3-4,13-14H2,1-2H3InChIKey
UKPUMJLBBGVBGJ-UHFFFAOYSA-NSynonyms
5(((5(4chlorophenyl)4propyl4H124triazol3yl)sulfanyl)methyl)3(2ethoxyphenyl)124oxadiazole
5((5(4chlorophenyl)4propyl124triazol3yl)sulfanylmethyl)3(2ethoxyphenyl)124oxadiazole
CCCN1C(=NN=C1SCC2=NC(=NO2)C3=CC=CC=C3OCC)C4=CC=C(C=C4)Cl
InChI=1SC22H22ClN5O2Sc13132821(1591116(23)121015)252622(28)3114192420(273019)17756818(17)2942h512H341314H212H3
MFCD14812423
ZINC000008612713
ZINC8612713
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