Vitas-M small molecule compound
(8R,8aS)-6-amino-8-(4-fluorophenyl)-2-(propan-2-yl)-2,3,8,8a-tetrahydroisoquinoline-5,7,7(1H)-tricarbonitrile
Catalog ID
STK748644
SMILES N#CC1=C(N)C([C@H]([C@H]2C1=CCN(C2)C(C)C)c1ccc(cc1)F)(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 C21H20FN5 MW 361.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20FN5/c1-13(2)27-8-7-16-17(9-23)20(26)21(11-24,12-25)19(18(16)10-27)14-3-5-15(22)6-4-14/h3-7,13,18-19H,8,10,26H2,1-2H3/t18-,19+/m1/s1InChIKey
ZMTLCAPZKNXEDU-MOPGFXCFSA-NSynonyms
(8R8aS)6amino8(4fluorophenyl)2(propan2yl)2388atetrahydroisoquinoline577(1H)tricarbonitrile
(8R8aS)6amino8(4fluorophenyl)2propan2yl1388atetrahydroisoquinoline577tricarbonitrile
6amino8(4fluorophenyl)2isopropyl2388atetrahydroisoquinoline577(1H)tricarbonitrile
CC(C)N1CC=C2C(C1)C(C(C(=C2C#N)N)(C#N)C#N)C3=CC=C(C=C3)F
InChI=1SC21H20FN5c113(2)27871617(923)20(26)21(11241225)19(18(16)1027)143515(22)6414h37131819H81026H212H3t1819+m1s1
MFCD13372015
N#CC1=C(N)C((C@H)((C@H)2C1=CCN(C2)C(C)C)c1ccc(cc1)F)(C#N)C#N
N#CC1=C(N)C(C(C2C1=CCN(C2)C(C)C)c1ccc(cc1)F)(C#N)C#N
ZINC000000705036
ZINC00705036
ZINC705036
Check stock
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Check stock on Vitas-MAvailable files
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