Vitas-M small molecule compound
2-{[5-(1-benzofuran-2-yl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2,5-dimethoxyphenyl)acetamide
Catalog ID
STK221581
SMILES COc1ccc(c(c1)NC(=O)CSc1nnc(n1C)c1cc2c(o1)cccc2)OC
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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 C21H20N4O4S MW 424.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N4O4S/c1-25-20(18-10-13-6-4-5-7-16(13)29-18)23-24-21(25)30-12-19(26)22-15-11-14(27-2)8-9-17(15)28-3/h4-11H,12H2,1-3H3,(H,22,26)InChIKey
PRGKBJXEDMQYGO-UHFFFAOYSA-NSynonyms
2((5(1BENZOFURAN2YL)4METHYL124TRIAZOL3YL)SULFANYL)N(25DIMETHOXYPHENYL)ACETAMIDE
2((5(1BENZOFURAN2YL)4METHYL4H124TRIAZOL3YL)SULFANYL)N(25DIMETHOXYPHENYL)ACETAMIDE
CN1C(=NN=C1SCC(=O)NC2=C(C=CC(=C2)OC)OC)C3=CC4=CC=CC=C4O3
InChI=1SC21H20N4O4Sc12520(181013645716(13)2918)232421(25)301219(26)22151114(272)8917(15)283h411H12H213H3(H2226)
MFCD07399547
ZINC000009263191
ZINC09263191
ZINC9263191
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