Vitas-M small molecule compound
2-[(5-amino-4H-1,2,4-triazol-3-yl)sulfanyl]-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethanone
Catalog ID
STK354741
SMILES O=C(c1ccc2c(c1)OCCO2)CSc1nnc([nH]1)N
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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 C12H12N4O3S MW 292.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H12N4O3S/c13-11-14-12(16-15-11)20-6-8(17)7-1-2-9-10(5-7)19-4-3-18-9/h1-2,5H,3-4,6H2,(H3,13,14,15,16)InChIKey
ZPRJEWKRBNAHEN-UHFFFAOYSA-NSynonyms
690643-24-41(2H3HBENZO(34E)14DIOXIN6YL)2(5AMINO(4H124TRIAZOL3YLTHIO))ETHAN1ONE
2((5AMINO1H124TRIAZOL3YL)SULFANYL)1(23DIHYDRO14BENZODIOXIN6YL)ETHANONE
2((5AMINO1H124TRIAZOL3YL)THIO)1(23DIHYDROBENZO(B)(14)DIOXIN6YL)ETHANONE
2((5amino4H124triazol3yl)sulfanyl)1(23dihydro14benzodioxin6yl)ethanone
690643244
C1COC2=C(O1)C=CC(=C2)C(=O)CSC3=NNC(=N3)N
InChI=1SC12H12N4O3Sc13111412(161511)2068(17)712910(57)1943189h125H346H2(H313141516)
MFCD06480233
O=C(c1ccc2c(c1)OCCO2)CSc1nnc((nH)1)N
ZINC000002846108
ZINC02846108
ZINC2846108
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