Vitas-M small molecule compound
2-[2-oxo-2-(1,3,4,5-tetrahydro-2H-pyrido[4,3-b]indol-2-yl)ethyl]-2,5,6,7,8,9-hexahydro-3H-cyclohepta[c]pyridazin-3-one
Catalog ID
STL249347
SMILES O=C(N1CCc2c(C1)c1ccccc1[nH]2)Cn1nc2CCCCCc2cc1=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 C22H24N4O2 MW 376.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H24N4O2/c27-21-12-15-6-2-1-3-8-18(15)24-26(21)14-22(28)25-11-10-20-17(13-25)16-7-4-5-9-19(16)23-20/h4-5,7,9,12,23H,1-3,6,8,10-11,13-14H2InChIKey
AUUXSOMZVKMXIJ-UHFFFAOYSA-NSynonyms
1351700-07-61351700076
2(2(34dihydro1Hpyrido(43b)indol2(5H)yl)2oxoethyl)6789tetrahydro2Hcyclohepta(c)pyridazin3(5H)one
2(2oxo2(1345tetrahydro2Hpyrido(43b)indol2yl)ethyl)256789hexahydro3Hcyclohepta(c)pyridazin3one
2(2oxo2(1345tetrahydropyrido(43b)indol2yl)ethyl)6789tetrahydro5Hcyclohepta(c)pyridazin3one
C1CCC2=CC(=O)N(N=C2CC1)CC(=O)N3CCC4=C(C3)C5=CC=CC=C5N4
InChI=1SC22H24N4O2c272112156213818(15)2426(21)1422(28)2511102017(1325)16745919(16)2320h45791223H136810111314H2
MFCD20536371
O=C(N1CCc2c(C1)c1ccccc1(nH)2)Cn1nc2CCCCCc2cc1=O
ZINC000072401221
ZINC72401221
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