Vitas-M small molecule compound

benzyl (8S,8aR)-6-amino-5,7,7-tricyano-8-[3-methoxy-4-(propan-2-yloxy)phenyl]-3,7,8,8a-tetrahydroisoquinoline-2(1H)-carboxylate

Catalog ID
STK024702
SMILES N#CC1=C(N)C([C@@H]([C@@H]2C1=CCN(C2)C(=O)OCc1ccccc1)c1ccc(c(c1)OC)OC(C)C)(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 C30H29N5O4 MW 523.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H29N5O4/c1-19(2)39-25-10-9-21(13-26(25)37-3)27-24-15-35(29(36)38-16-20-7-5-4-6-8-20)12-11-22(24)23(14-31)28(34)30(27,17-32)18-33/h4-11,13,19,24,27H,12,15-16,34H2,1-3H3/t24-,27+/m0/s1
InChIKey
XLSAJSOSYGOYMV-RPLLCQBOSA-N
Synonyms
303959-65-1
(8S8aR)benzyl6amino577tricyano8(4isopropoxy3methoxyphenyl)1788atetrahydroisoquinoline2(3H)carboxylate
303959651
benzyl(8S8aR)6amino577tricyano8(3methoxy4(propan2yloxy)phenyl)3788atetrahydroisoquinoline2(1H)carboxylate
benzyl(8S8aR)6amino577tricyano8(3methoxy4propan2yloxyphenyl)1388atetrahydroisoquinoline2carboxylate
CC(C)OC1=C(C=C(C=C1)C2C3CN(CC=C3C(=C(C2(C#N)C#N)N)C#N)C(=O)OCC4=CC=CC=C4)OC
InChI=1SC30H29N5O4c119(2)392510921(1326(25)373)27241535(29(36)3816207546820)121122(24)23(1431)28(34)30(271732)1833h41113192427H12151634H213H3t2427+m0s1
N#CC1=C(N)C((C@@H)((C@@H)2C1=CCN(C2)C(=O)OCc1ccccc1)c1ccc(c(c1)OC)OC(C)C)(C#N)C#N
STK024702
ZINC000026607751
ZINC26607751

Check stock

See real-time availability and sample size for STK024702 on the Vitas-M platform.

Check stock on Vitas-M

Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.