Vitas-M small molecule compound
2-{[5-(1-benzofuran-2-yl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide
Catalog ID
STK261223
SMILES O=C(Nc1ccc2c(c1)OCCO2)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 C21H18N4O4S MW 422.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18N4O4S/c1-25-20(18-10-13-4-2-3-5-15(13)29-18)23-24-21(25)30-12-19(26)22-14-6-7-16-17(11-14)28-9-8-27-16/h2-7,10-11H,8-9,12H2,1H3,(H,22,26)InChIKey
HAWYTFHQZPSJPV-UHFFFAOYSA-NSynonyms
2((5(1benzofuran2yl)4methyl124triazol3yl)sulfanyl)N(23dihydro14benzodioxin6yl)acetamide
2((5(1benzofuran2yl)4methyl4H124triazol3yl)sulfanyl)N(23dihydro14benzodioxin6yl)acetamide
2(5BENZOFURAN2YL4METHYL4H(124)TRIAZOL3YLSULFANYL)N(23DIHYDROBENZO(14)DIOXIN6YL)ACETAMIDE
CN1C(=NN=C1SCC(=O)NC2=CC3=C(C=C2)OCCO3)C4=CC5=CC=CC=C5O4
InChI=1SC21H18N4O4Sc12520(181013423515(13)2918)232421(25)301219(26)2214671617(1114)28982716h271011H8912H21H3(H2226)
MFCD08684936
ZINC000009426894
ZINC09426894
ZINC9426894
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