Vitas-M small molecule compound
methyl 4-(3-amino-7-tert-butyl-2,2,4-tricyano-1,2,6,7,8,8a-hexahydronaphthalen-1-yl)benzoate
Catalog ID
STL335330
SMILES COC(=O)c1ccc(cc1)C1C2CC(CC=C2C(=C(C1(C#N)C#N)N)C#N)C(C)(C)C
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 C25H26N4O2 MW 414.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H26N4O2/c1-24(2,3)17-9-10-18-19(11-17)21(15-5-7-16(8-6-15)23(30)31-4)25(13-27,14-28)22(29)20(18)12-26/h5-8,10,17,19,21H,9,11,29H2,1-4H3InChIKey
IPGNINWFQWONDC-UHFFFAOYSA-NSynonyms
CC(C)(C)C1CC=C2C(C1)C(C(C(=C2C#N)N)(C#N)C#N)C3=CC=C(C=C3)C(=O)OC
COC(=O)c1ccc(cc1)(C@@H)1(C@H)2CC(CC=C2C(=C(C1(C#N)C#N)N)C#N)C(C)(C)C
InChI=1SC25H26N4O2c124(23)179101819(1117)21(155716(8615)23(30)314)25(13271428)22(29)20(18)1226h5810171921H91129H214H3
methyl4((1S8aR)3amino7(tertbutyl)224tricyano126788ahexahydronaphthalen1yl)benzoate
methyl4(3amino7tertbutyl224tricyano126788ahexahydronaphthalen1yl)benzoate
methyl4(3amino7tertbutyl224tricyano6788atetrahydro1Hnaphthalen1yl)benzoate
MFCD03807549
ZINC000001245099
ZINC000106533968
Check stock
See real-time availability and sample size for STL335330 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.