Vitas-M small molecule compound
1-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-[(5-methyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]butan-1-one
Catalog ID
STK723625
SMILES O=C(c1ccc2c(c1)OCCO2)CCCSc1nnc2c(n1)n(C)c1c2cccc1
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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 C22H20N4O3S MW 420.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20N4O3S/c1-26-16-6-3-2-5-15(16)20-21(26)23-22(25-24-20)30-12-4-7-17(27)14-8-9-18-19(13-14)29-11-10-28-18/h2-3,5-6,8-9,13H,4,7,10-12H2,1H3InChIKey
JPYWIFLEEAZZNY-UHFFFAOYSA-NSynonyms
1(23DIHYDRO14BENZODIOXIN6YL)4((5METHYL(124)TRIAZINO(56B)INDOL3YL)SULFANYL)BUTAN1ONE
1(23dihydro14benzodioxin6yl)4((5methyl5H(124)triazino(56b)indol3yl)sulfanyl)butan1one
CN1C2=CC=CC=C2C3=C1N=C(N=N3)SCCCC(=O)C4=CC5=C(C=C4)OCCO5
InChI=1SC22H20N4O3Sc12616632515(16)2021(26)2322(252420)30124717(27)14891819(1314)2911102818h23568913H471012H21H3
MFCD05856845
ZINC000002883048
ZINC02883048
ZINC2883048
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