Vitas-M small molecule compound
3-(7-methoxy-1-benzofuran-2-yl)-5-{[2-(2-methoxyphenoxy)ethyl]sulfanyl}-4-methyl-4H-1,2,4-triazole
Catalog ID
STK246052
SMILES COc1ccccc1OCCSc1nnc(n1C)c1cc2c(o1)c(OC)ccc2
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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 C21H21N3O4S MW 411.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21N3O4S/c1-24-20(18-13-14-7-6-10-17(26-3)19(14)28-18)22-23-21(24)29-12-11-27-16-9-5-4-8-15(16)25-2/h4-10,13H,11-12H2,1-3H3InChIKey
MAUHCGPXORVSFN-UHFFFAOYSA-NSynonyms
3(7METHOXY1BENZOFURAN2YL)5((2(2METHOXYPHENOXY)ETHYL)SULFANYL)4METHYL4H124TRIAZOLE
3(7METHOXY1BENZOFURAN2YL)5(2(2METHOXYPHENOXY)ETHYLSULFANYL)4METHYL124TRIAZOLE
CN1C(=NN=C1SCCOC2=CC=CC=C2OC)C3=CC4=C(O3)C(=CC=C4)OC
InChI=1SC21H21N3O4Sc12420(181314761017(263)19(14)2818)222321(24)2912112716954815(16)252h41013H1112H213H3
MFCD08670945
ZINC000007341802
ZINC07341802
ZINC7341802
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