Vitas-M small molecule compound
5-({[5-benzyl-4-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-3-(4-ethoxyphenyl)-1,2,4-oxadiazole
Catalog ID
STL415635
SMILES CCOc1ccc(cc1)c1noc(n1)CSc1nnc(n1c1cccc(c1)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/c1-3-33-23-14-12-21(13-15-23)26-28-25(34-31-26)18-35-27-30-29-24(17-20-9-5-4-6-10-20)32(27)22-11-7-8-19(2)16-22/h4-16H,3,17-18H2,1-2H3InChIKey
VQQBZTNRGPPYFN-UHFFFAOYSA-NSynonyms
5(((5benzyl4(3methylphenyl)4H124triazol3yl)sulfanyl)methyl)3(4ethoxyphenyl)124oxadiazole
5((5benzyl4(3methylphenyl)124triazol3yl)sulfanylmethyl)3(4ethoxyphenyl)124oxadiazole
CCOC1=CC=C(C=C1)C2=NOC(=N2)CSC3=NN=C(N3C4=CC=CC(=C4)C)CC5=CC=CC=C5
InChI=1SC27H25N5O2Sc133323141221(131523)262825(343126)183527302924(172095461020)32(27)22117819(2)1622h416H31718H212H3
MFCD14812509
ZINC000008612753
ZINC8612753
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