Vitas-M small molecule compound
2-amino-4-(6-bromo-1,3-benzodioxol-5-yl)-6-tert-butyl-4H-pyran-3,5-dicarbonitrile
Catalog ID
STK075490
SMILES N#CC1=C(N)OC(=C(C1c1cc2OCOc2cc1Br)C#N)C(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 C18H16BrN3O3 MW 402.25 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16BrN3O3/c1-18(2,3)16-10(6-20)15(11(7-21)17(22)25-16)9-4-13-14(5-12(9)19)24-8-23-13/h4-5,15H,8,22H2,1-3H3InChIKey
QVVAQOBOUZISFJ-UHFFFAOYSA-NSynonyms
371212-49-6(4R)2AMINO4(6BROMO13BENZODIOXOL5YL)6TERTBUTYL4HPYRAN35DICARBONITRILE
(4S)2AMINO4(6BROMO13BENZODIOXOL5YL)6TERTBUTYL4HPYRAN35DICARBONITRILE
2AMINO4(6BROMO13BENZODIOXOL5YL)6TERTBUTYL4HPYRAN35DICARBONITRILE
2amino4(6bromobenzo(d)(13)dioxol5yl)6(tertbutyl)4Hpyran35dicarbonitrile
371212496
CC(C)(C)C1=C(C(C(=C(O1)N)C#N)C2=CC3=C(C=C2Br)OCO3)C#N
InChI=1SC18H16BrN3O3c118(23)1610(620)15(11(721)17(22)2516)941314(512(9)19)2482313h4515H822H213H3
MFCD03009998
N#CC1=C(N)OC(=C(C1c1cc2OCOc2cc1Br)C#N)C(C)(C)C
STK075490
ZINC000001480474
ZINC000001480475
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