Vitas-M small molecule compound
1-[4-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-sulfanyl-4H-1,2,4-triazol-3-yl]propan-2-ol
Catalog ID
STK447363
SMILES CC(Cc1nnc(n1c1ccc2c(c1)OCCO2)S)O
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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 C13H15N3O3S MW 293.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H15N3O3S/c1-8(17)6-12-14-15-13(20)16(12)9-2-3-10-11(7-9)19-5-4-18-10/h2-3,7-8,17H,4-6H2,1H3,(H,15,20)InChIKey
MVEDPDNUPLCBAW-UHFFFAOYSA-NSynonyms
1(4(23dihydro14benzodioxin6yl)5sulfanyl4H124triazol3yl)propan2ol
1(4(2H3HBENZO(34E)14DIOXAN6YL)5SULFANYL124TRIAZOL3YL)PROPAN2OL
4(23dihydro14benzodioxin6yl)3(2hydroxypropyl)1H124triazole5thione
CC(CC1=NNC(=S)N1C2=CC3=C(C=C2)OCCO3)O
InChI=1SC13H15N3O3Sc18(17)612141513(20)16(12)9231011(79)19541810h237817H46H21H3(H1520)
MFCD04059488
ZINC000006521333
ZINC000006524638
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