Vitas-M small molecule compound
(8R,8aR)-6-amino-2-benzyl-8-(2-methoxynaphthalen-1-yl)-2,3,8,8a-tetrahydroisoquinoline-5,7,7(1H)-tricarbonitrile
Catalog ID
STK541600
SMILES N#CC1=C(N)C([C@@H]([C@@H]2C1=CCN(C2)Cc1ccccc1)c1c(OC)ccc2c1cccc2)(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 C30H25N5O MW 471.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H25N5O/c1-36-26-12-11-21-9-5-6-10-22(21)27(26)28-25-17-35(16-20-7-3-2-4-8-20)14-13-23(25)24(15-31)29(34)30(28,18-32)19-33/h2-13,25,28H,14,16-17,34H2,1H3/t25-,28-/m0/s1InChIKey
IZNJLNXVBGLSPH-LSYYVWMOSA-NSynonyms
494792-23-3(8R8aR)6amino2benzyl8(2methoxynaphthalen1yl)1388atetrahydroisoquinoline577tricarbonitrile
(8R8aR)6amino2benzyl8(2methoxynaphthalen1yl)2388atetrahydroisoquinoline577(1H)tricarbonitrile
494792233
COC1=C(C2=CC=CC=C2C=C1)C3C4CN(CC=C4C(=C(C3(C#N)C#N)N)C#N)CC5=CC=CC=C5
InChI=1SC30H25N5Oc136261211219561022(21)27(26)28251735(16207324820)141323(25)24(1531)29(34)30(281832)1933h2132528H14161734H21H3t2528m0s1
MFCD18241915
N#CC1=C(N)C((C@@H)((C@@H)2C1=CCN(C2)Cc1ccccc1)c1c(OC)ccc2c1cccc2)(C#N)C#N
ZINC000019851847
ZINC19851847
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