Vitas-M small molecule compound
{[5-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetic acid
Catalog ID
STK279359
SMILES CCn1c(SCC(=O)O)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 C14H15N3O4S MW 321.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H15N3O4S/c1-2-17-13(15-16-14(17)22-8-12(18)19)9-3-4-10-11(7-9)21-6-5-20-10/h3-4,7H,2,5-6,8H2,1H3,(H,18,19)InChIKey
DCMHBXSCZPGWAR-UHFFFAOYSA-NSynonyms
((5(23DIHYDRO14BENZODIOXIN6YL)4ETHYL4H124TRIAZOL3YL)SULFANYL)ACETICACID
2((5(23dihydro14benzodioxin6yl)4ethyl124triazol3yl)sulfanyl)aceticacid
CCN1C(=NN=C1SCC(=O)O)C2=CC3=C(C=C2)OCCO3
InChI=1SC14H15N3O4Sc121713(151614(17)22812(18)19)9341011(79)21652010h347H2568H21H3(H1819)
MFCD09269797
ZINC000009193258
ZINC9193258
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