Vitas-M small molecule compound
benzyl (8R,8aR)-6-amino-5,7,7-tricyano-8-(2,6-dichlorophenyl)-3,7,8,8a-tetrahydroisoquinoline-2(1H)-carboxylate
Catalog ID
STK543867
SMILES N#CC1=C(N)C([C@@H]([C@@H]2C1=CCN(C2)C(=O)OCc1ccccc1)c1c(Cl)cccc1Cl)(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 C26H19Cl2N5O2 MW 504.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H19Cl2N5O2/c27-20-7-4-8-21(28)22(20)23-19-12-33(25(34)35-13-16-5-2-1-3-6-16)10-9-17(19)18(11-29)24(32)26(23,14-30)15-31/h1-9,19,23H,10,12-13,32H2/t19-,23-/m0/s1InChIKey
KKRKWBUFJPVDCO-CVDCTZTESA-NSynonyms
413576-61-1(8R8aR)benzyl6amino577tricyano8(26dichlorophenyl)1788atetrahydroisoquinoline2(3H)carboxylate
413576611
benzyl(8R8aR)6amino577tricyano8(26dichlorophenyl)1388atetrahydroisoquinoline2carboxylate
benzyl(8R8aR)6amino577tricyano8(26dichlorophenyl)3788atetrahydroisoquinoline2(1H)carboxylate
C1C=C2C(CN1C(=O)OCC3=CC=CC=C3)C(C(C(=C2C#N)N)(C#N)C#N)C4=C(C=CC=C4Cl)Cl
InChI=1SC26H19Cl2N5O2c272074821(28)22(20)23191233(25(34)3513165213616)10917(19)18(1129)24(32)26(231430)1531h191923H10121332H2t1923m0s1
MFCD18242109
N#CC1=C(N)C((C@@H)((C@@H)2C1=CCN(C2)C(=O)OCc1ccccc1)c1c(Cl)cccc1Cl)(C#N)C#N
ZINC000008441980
ZINC08441980
ZINC8441980
Check stock
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