Vitas-M small molecule compound

5-({[5-benzyl-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-3-(4-ethoxyphenyl)-1,2,4-oxadiazole

Catalog ID
STL415639
SMILES CCOc1ccc(cc1)c1noc(n1)CSc1nnc(n1c1ccc(cc1)C)Cc1ccccc1

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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 C27H25N5O2S MW 483.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H25N5O2S/c1-3-33-23-15-11-21(12-16-23)26-28-25(34-31-26)18-35-27-30-29-24(17-20-7-5-4-6-8-20)32(27)22-13-9-19(2)10-14-22/h4-16H,3,17-18H2,1-2H3
InChIKey
UXOZBSSFHAFUNL-UHFFFAOYSA-N
Synonyms

5(((5benzyl4(4methylphenyl)4H124triazol3yl)sulfanyl)methyl)3(4ethoxyphenyl)124oxadiazole
5((5benzyl4(4methylphenyl)124triazol3yl)sulfanylmethyl)3(4ethoxyphenyl)124oxadiazole
CCOC1=CC=C(C=C1)C2=NOC(=N2)CSC3=NN=C(N3C4=CC=C(C=C4)C)CC5=CC=CC=C5
InChI=1SC27H25N5O2Sc133323151121(121623)262825(343126)183527302924(17207546820)32(27)2213919(2)101422h416H31718H212H3
MFCD14812512
ZINC000009185135
ZINC9185135

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Available files

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