Vitas-M small molecule compound
2'-imino-2-oxohexahydro-2'H-spiro[cyclohexane-1,4'-[1]oxa[3,9a]methano[1]benzoxepine]-3',10',10'-tricarbonitrile
Catalog ID
STK539354
SMILES N#CC1(C#N)C23CCCCC3CC3(C1(C#N)C(=N)O2)CCCCC3=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 C19H20N4O2 MW 336.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H20N4O2/c20-10-17(11-21)18(12-22)15(23)25-19(17)8-4-1-5-13(19)9-16(18)7-3-2-6-14(16)24/h13,23H,1-9H2/b23-15+InChIKey
WZHIALLOUWXHNU-HZHRSRAPSA-NSynonyms
2imino2oxohexahydro2Hspiro(cyclohexane14(1)oxa(39a)methano(1)benzoxepine)31010tricarbonitrile
2imino2oxooctahydrospiro(39amethanobenzo(b)oxepine41cyclohexane)31010tricarbonitrile
MFCD01951565
ZINC000102686824
ZINC000169466107
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