Vitas-M small molecule compound
2-{[5-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(propan-2-yl)acetamide
Catalog ID
STK279331
SMILES CCn1c(SCC(=O)NC(C)C)nnc1c1ccc2c(c1)OCCO2
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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 C17H22N4O3S MW 362.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H22N4O3S/c1-4-21-16(12-5-6-13-14(9-12)24-8-7-23-13)19-20-17(21)25-10-15(22)18-11(2)3/h5-6,9,11H,4,7-8,10H2,1-3H3,(H,18,22)InChIKey
PSDSEWZTWWNKFL-UHFFFAOYSA-NSynonyms
2((5(23dihydro14benzodioxin6yl)4ethyl124triazol3yl)sulfanyl)Npropan2ylacetamide
2((5(23DIHYDRO14BENZODIOXIN6YL)4ETHYL4H124TRIAZOL3YL)SULFANYL)N(PROPAN2YL)ACETAMIDE
CCN1C(=NN=C1SCC(=O)NC(C)C)C2=CC3=C(C=C2)OCCO3
InChI=1SC17H22N4O3Sc142116(12561314(912)24872313)192017(21)251015(22)1811(2)3h56911H47810H213H3(H1822)
MFCD09269769
ZINC000009096197
ZINC09096197
ZINC9096197
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