Vitas-M small molecule compound
2-{[5-(1-benzofuran-2-yl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(4-methoxyphenyl)ethanone
Catalog ID
STK186942
SMILES COc1ccc(cc1)C(=O)CSc1nnc(n1C)c1cc2c(o1)cccc2
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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 C20H17N3O3S MW 379.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17N3O3S/c1-23-19(18-11-14-5-3-4-6-17(14)26-18)21-22-20(23)27-12-16(24)13-7-9-15(25-2)10-8-13/h3-11H,12H2,1-2H3InChIKey
VGBYZHSXERTBQL-UHFFFAOYSA-NSynonyms
2((5(1BENZOFURAN2YL)4METHYL124TRIAZOL3YL)SULFANYL)1(4METHOXYPHENYL)ETHANONE
2((5(1BENZOFURAN2YL)4METHYL4H124TRIAZOL3YL)SULFANYL)1(4METHOXYPHENYL)ETHANONE
CN1C(=NN=C1SCC(=O)C2=CC=C(C=C2)OC)C3=CC4=CC=CC=C4O3
InChI=1SC20H17N3O3Sc12319(181114534617(14)2618)212220(23)271216(24)137915(252)10813h311H12H212H3
MFCD06005415
ZINC000001056873
ZINC01056873
ZINC1056873
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