Vitas-M small molecule compound
2-{[4-ethyl-5-(7-methoxy-1-benzofuran-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2-methylphenyl)acetamide
Catalog ID
STK138117
SMILES COc1cccc2c1oc(c2)c1nnc(n1CC)SCC(=O)Nc1ccccc1C
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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 C22H22N4O3S MW 422.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22N4O3S/c1-4-26-21(18-12-15-9-7-11-17(28-3)20(15)29-18)24-25-22(26)30-13-19(27)23-16-10-6-5-8-14(16)2/h5-12H,4,13H2,1-3H3,(H,23,27)InChIKey
LCKSNIRSJUMLTH-UHFFFAOYSA-NSynonyms
2((4ETHYL5(7METHOXY1BENZOFURAN2YL)124TRIAZOL3YL)SULFANYL)N(2METHYLPHENYL)ACETAMIDE
2((4ETHYL5(7METHOXY1BENZOFURAN2YL)4H124TRIAZOL3YL)SULFANYL)N(2METHYLPHENYL)ACETAMIDE
CCN1C(=NN=C1SCC(=O)NC2=CC=CC=C2C)C3=CC4=C(O3)C(=CC=C4)OC
InChI=1SC22H22N4O3Sc142621(181215971117(283)20(15)2918)242522(26)301319(27)23161065814(16)2h512H413H213H3(H2327)
MFCD04330493
ZINC000009851590
ZINC09851590
ZINC9851590
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