Vitas-M small molecule compound
3-(2-ethoxyphenyl)-5-({[5-methyl-4-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-1,2,4-oxadiazole
Catalog ID
STL415584
SMILES CCOc1ccccc1c1noc(n1)CSc1nnc(n1c1cccc(c1)C)C
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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 C21H21N5O2S MW 407.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21N5O2S/c1-4-27-18-11-6-5-10-17(18)20-22-19(28-25-20)13-29-21-24-23-15(3)26(21)16-9-7-8-14(2)12-16/h5-12H,4,13H2,1-3H3InChIKey
HCYZGBWBBDVKSE-UHFFFAOYSA-NSynonyms
3(2ethoxyphenyl)5(((5methyl4(3methylphenyl)4H124triazol3yl)sulfanyl)methyl)124oxadiazole
3(2ethoxyphenyl)5((5methyl4(3methylphenyl)124triazol3yl)sulfanylmethyl)124oxadiazole
CCOC1=CC=CC=C1C2=NOC(=N2)CSC3=NN=C(N3C4=CC=CC(=C4)C)C
InChI=1SC21H21N5O2Sc14271811651017(18)202219(282520)132921242315(3)26(21)1697814(2)1216h512H413H213H3
MFCD14812431
ZINC000012813683
ZINC12813683
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