Vitas-M small molecule compound
4-amino-2'-oxo-1',2',6,7,11,12-hexahydro-10H-spiro[1,4-dioxepino[2,3-g]pyrido[2,1-a]isoquinoline-2,3'-indole]-3-carbonitrile
Catalog ID
STK590526
SMILES N#CC1=C(N)N2CCc3c(C2=CC21C(=O)Nc1c2cccc1)cc1c(c3)OCCCO1
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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 C24H20N4O3 MW 412.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H20N4O3/c25-13-17-22(26)28-7-6-14-10-20-21(31-9-3-8-30-20)11-15(14)19(28)12-24(17)16-4-1-2-5-18(16)27-23(24)29/h1-2,4-5,10-12H,3,6-9,26H2,(H,27,29)InChIKey
FKBIXBWDASLRFS-UHFFFAOYSA-NSynonyms
898918-26-84amino2oxo12671112hexahydro10Hspiro(14dioxepino(23g)pyrido(21a)isoquinoline23indole)3carbonitrile
4amino2oxo7101112tetrahydro6Hspiro((14)dioxepino(23g)pyrido(21a)isoquinoline23indoline)3carbonitrile
898918268
C1COC2=C(C=C3C(=C2)CCN4C3=CC5(C6=CC=CC=C6NC5=O)C(=C4N)C#N)OC1
InChI=1SC24H20N4O3c25131722(26)287614102021(319383020)1115(14)19(28)1224(17)16412518(16)2723(24)29h12451012H36926H2(H2729)
MFCD07638766
ZINC000005422288
ZINC000005422302
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