Vitas-M small molecule compound

6-amino-8-(4-ethoxyphenyl)-2-methyl-2,3,8,8a-tetrahydroisoquinoline-5,7,7(1H)-tricarbonitrile

Catalog ID
STK777303
SMILES CCOc1ccc(cc1)C1C2CN(C)CC=C2C(=C(C1(C#N)C#N)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 C21H21N5O MW 359.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21N5O/c1-3-27-15-6-4-14(5-7-15)19-18-11-26(2)9-8-16(18)17(10-22)20(25)21(19,12-23)13-24/h4-8,18-19H,3,9,11,25H2,1-2H3
InChIKey
AEKSTGQRWRJXSA-UHFFFAOYSA-N
Synonyms

6amino8(4ethoxyphenyl)2methyl1388atetrahydroisoquinoline577tricarbonitrile
6amino8(4ethoxyphenyl)2methyl2388atetrahydroisoquinoline577(1H)tricarbonitrile
CCOC1=CC=C(C=C1)C2C3CN(CC=C3C(=C(C2(C#N)C#N)N)C#N)C
InChI=1SC21H21N5Oc1327156414(5715)19181126(2)9816(18)17(1022)20(25)21(191223)1324h481819H391125H212H3
MFCD00128649
ZINC000000644137
ZINC000019799211

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Available files

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