Vitas-M small molecule compound
(8R,8aS)-6-amino-2-benzyl-8-(2,3-dichlorophenyl)-2,3,8,8a-tetrahydroisoquinoline-5,7,7(1H)-tricarbonitrile
Catalog ID
STK524827
SMILES N#CC1=C(N)C([C@@H]([C@H]2C1=CCN(C2)Cc1ccccc1)c1cccc(c1Cl)Cl)(C#N)C#N
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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 C25H19Cl2N5 MW 460.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H19Cl2N5/c26-21-8-4-7-18(23(21)27)22-20-13-32(12-16-5-2-1-3-6-16)10-9-17(20)19(11-28)24(31)25(22,14-29)15-30/h1-9,20,22H,10,12-13,31H2/t20-,22-/m1/s1InChIKey
OEUREKILIVGCPE-IFMALSPDSA-NSynonyms
(8R8aS)6amino2benzyl8(23dichlorophenyl)1388atetrahydroisoquinoline577tricarbonitrile
(8R8aS)6amino2benzyl8(23dichlorophenyl)2388atetrahydroisoquinoline577(1H)tricarbonitrile
302942047
C1C=C2C(CN1CC3=CC=CC=C3)C(C(C(=C2C#N)N)(C#N)C#N)C4=C(C(=CC=C4)Cl)Cl
InChI=1SC25H19Cl2N5c262184718(23(21)27)22201332(12165213616)10917(20)19(1128)24(31)25(221429)1530h192022H10121331H2t2022m1s1
N#CC1=C(N)C((C@@H)((C@H)2C1=CCN(C2)Cc1ccccc1)c1cccc(c1Cl)Cl)(C#N)C#N
ZINC000008934193
ZINC08934193
ZINC8934193
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