Vitas-M small molecule compound
(8R,8aS)-6-amino-8-(2,3-dichlorophenyl)-2-ethyl-2,3,8,8a-tetrahydroisoquinoline-5,7,7(1H)-tricarbonitrile
Catalog ID
STK754091
SMILES CCN1CC=C2[C@@H](C1)[C@@H](c1cccc(c1Cl)Cl)C(C(=C2C#N)N)(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 C20H17Cl2N5 MW 398.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17Cl2N5/c1-2-27-7-6-12-14(8-23)19(26)20(10-24,11-25)17(15(12)9-27)13-4-3-5-16(21)18(13)22/h3-6,15,17H,2,7,9,26H2,1H3/t15-,17-/m1/s1InChIKey
YSBSLQRCXADTIO-NVXWUHKLSA-NSynonyms
293728-61-7(8R8aS)6amino8(23dichlorophenyl)2ethyl1388atetrahydroisoquinoline577tricarbonitrile
(8R8aS)6amino8(23dichlorophenyl)2ethyl2388atetrahydroisoquinoline577(1H)tricarbonitrile
293728617
CCN1CC=C2(C@@H)(C1)(C@@H)(c1cccc(c1Cl)Cl)C(C(=C2C#N)N)(C#N)C#N
CCN1CC=C2C(C1)C(C(C(=C2C#N)N)(C#N)C#N)C3=C(C(=CC=C3)Cl)Cl
InChI=1SC20H17Cl2N5c1227761214(823)19(26)20(10241125)17(15(12)927)1343516(21)18(13)22h361517H27926H21H3t1517m1s1
MFCD13372052
ZINC000004115193
ZINC04115193
ZINC4115193
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