Vitas-M small molecule compound
benzyl (8S,8aR)-6-amino-5,7,7-tricyano-8-[4-(methoxycarbonyl)phenyl]-3,7,8,8a-tetrahydroisoquinoline-2(1H)-carboxylate
Catalog ID
STK045361
SMILES N#CC1=C(N)C([C@@H]([C@@H]2C1=CCN(C2)C(=O)OCc1ccccc1)c1ccc(cc1)C(=O)OC)(C#N)C#N
Contact us by email for worldwide delivery information, pricing, and real‑time availability. Send us your quotation request, and we will confirm stock levels, provide exact costs and lead times, suggest alternatives or find analogs when helpful, and share any additional specifications you may need.
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 C28H23N5O4 MW 493.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H23N5O4/c1-36-26(34)20-9-7-19(8-10-20)24-23-14-33(27(35)37-15-18-5-3-2-4-6-18)12-11-21(23)22(13-29)25(32)28(24,16-30)17-31/h2-11,23-24H,12,14-15,32H2,1H3/t23-,24+/m0/s1InChIKey
QFGBLJUIGBHRAS-BJKOFHAPSA-NSynonyms
benzyl(8S8aR)6amino577tricyano8(4(methoxycarbonyl)phenyl)3788atetrahydroisoquinoline2(1H)carboxylate
benzyl(8S8aR)6amino577tricyano8(4methoxycarbonylphenyl)1388atetrahydroisoquinoline2carboxylate
COC(=O)C1=CC=C(C=C1)C2C3CN(CC=C3C(=C(C2(C#N)C#N)N)C#N)C(=O)OCC4=CC=CC=C4
InChI=1SC28H23N5O4c13626(34)209719(81020)24231433(27(35)3715185324618)121121(23)22(1329)25(32)28(241630)1731h2112324H12141532H21H3t2324+m0s1
N#CC1=C(N)C((C@@H)((C@@H)2C1=CCN(C2)C(=O)OCc1ccccc1)c1ccc(cc1)C(=O)OC)(C#N)C#N
STK045361
ZINC000019852402
ZINC19852402
Check stock
See real-time availability and sample size for STK045361 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.