Vitas-M small molecule compound
2-{[3-(propan-2-yl)[1,2,4]triazolo[4,3-b]pyridazin-6-yl]sulfanyl}-1-(1,3,4,9-tetrahydro-2H-beta-carbolin-2-yl)ethanone
Catalog ID
STL568083
SMILES O=C(N1CCc2c(C1)[nH]c1c2cccc1)CSc1ccc2n(n1)c(nn2)C(C)C
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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 C21H22N6OS MW 406.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N6OS/c1-13(2)21-24-23-18-7-8-19(25-27(18)21)29-12-20(28)26-10-9-15-14-5-3-4-6-16(14)22-17(15)11-26/h3-8,13,22H,9-12H2,1-2H3InChIKey
RUXQAFQUICFFFL-UHFFFAOYSA-NSynonyms
1(34dihydro1Hpyrido(34b)indol2(9H)yl)2((3isopropyl(124)triazolo(43b)pyridazin6yl)thio)ethanone
125433128
2((3(propan2yl)(124)triazolo(43b)pyridazin6yl)sulfanyl)1(1349tetrahydro2Hbetacarbolin2yl)ethanone
2((3propan2yl(124)triazolo(43b)pyridazin6yl)sulfanyl)1(1349tetrahydropyrido(34b)indol2yl)ethanone
InChI=1SC21H22N6OSc113(2)212423187819(2527(18)21)291220(28)261091514534616(14)2217(15)1126h381322H912H212H3
MFCD32223040
O=C(N1CCc2c(C1)(nH)c1c2cccc1)CSc1ccc2n(n1)c(nn2)C(C)C
ZINC000524734569
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