Vitas-M small molecule compound
2-imino-10-[4-(prop-1-en-2-yl)cyclohex-1-en-1-yl]tetrahydro-8a,3-(epoxymethano)chromene-3,4,4(2H,4aH)-tricarbonitrile
Catalog ID
STL526466
SMILES N#CC12C(=N)OC3(OC1C1=CCC(CC1)C(=C)C)C(C2(C#N)C#N)CCCC3
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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/c1-14(2)15-6-8-16(9-7-15)18-21(13-25)19(26)28-22(27-18)10-4-3-5-17(22)20(21,11-23)12-24/h8,15,17-18,26H,1,3-7,9-10H2,2H3/b26-19-InChIKey
LOISBJJFWMKRLS-XHPQRKPJSA-NSynonyms
2imino10((S)4(prop1en2yl)cyclohex1en1yl)hexahydro8a3(epoxymethano)chromene344(4aH)tricarbonitrile
2imino10(4(prop1en2yl)cyclohex1en1yl)tetrahydro8a3(epoxymethano)chromene344(2H4aH)tricarbonitrile
InChI=1SC22H24N4O2c114(2)156816(9715)1821(1325)19(26)2822(2718)1043517(22)20(211123)1224h815171826H137910H22H3b2619
MFCD31753812
N#CC12C(=N)OC3(OC1C1=CC(C@H)(CC1)C(=C)C)C(C2(C#N)C#N)CCCC3
ZINC000105366929
ZINC000252694504
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