Vitas-M small molecule compound
5-({[5-benzyl-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-3-(2-ethoxyphenyl)-1,2,4-oxadiazole
Catalog ID
STL415590
SMILES CCOc1ccccc1c1noc(n1)CSc1nnc(n1c1ccc(cc1)OC)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 C27H25N5O3S MW 499.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H25N5O3S/c1-3-34-23-12-8-7-11-22(23)26-28-25(35-31-26)18-36-27-30-29-24(17-19-9-5-4-6-10-19)32(27)20-13-15-21(33-2)16-14-20/h4-16H,3,17-18H2,1-2H3InChIKey
VTWACRIZHZBSCZ-UHFFFAOYSA-NSynonyms
5(((5benzyl4(4methoxyphenyl)4H124triazol3yl)sulfanyl)methyl)3(2ethoxyphenyl)124oxadiazole
5((5benzyl4(4methoxyphenyl)124triazol3yl)sulfanylmethyl)3(2ethoxyphenyl)124oxadiazole
CCOC1=CC=CC=C1C2=NOC(=N2)CSC3=NN=C(N3C4=CC=C(C=C4)OC)CC5=CC=CC=C5
InChI=1SC27H25N5O3Sc13342312871122(23)262825(353126)183627302924(171995461019)32(27)20131521(332)161420h416H31718H212H3
MFCD14812439
ZINC000009185057
ZINC9185057
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