Vitas-M small molecule compound
(4aR)-2-amino-4-(4-chlorophenyl)-10-methyl-4,4a,5,6,7,8-hexahydro-3H-5,8-epiminobenzo[7]annulene-1,3,3-tricarbonitrile
Catalog ID
STK790754
SMILES N#CC1=C(N)C(C([C@@H]2C1=CC1CCC2N1C)c1ccc(cc1)Cl)(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 C21H18ClN5 MW 375.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18ClN5/c1-27-14-6-7-17(27)18-15(8-14)16(9-23)20(26)21(10-24,11-25)19(18)12-2-4-13(22)5-3-12/h2-5,8,14,17-19H,6-7,26H2,1H3/t14?,17?,18-,19?/m1/s1InChIKey
VQFVQSKBUXDLQC-UQQIVXHISA-NSynonyms
(4aR)2amino4(4chlorophenyl)10methyl44a5678hexahydro3H58epiminobenzo(7)annulene133tricarbonitrile
(4R4aS)2amino4(4chlorophenyl)10methyl44a5678hexahydro3H58epiminobenzo(7)annulene133tricarbonitrile
CN1C2CCC1C3C(C(C(=C(C3=C2)C#N)N)(C#N)C#N)C4=CC=C(C=C4)Cl
InChI=1SC21H18ClN5c127146717(27)1815(814)16(923)20(26)21(10241125)19(18)122413(22)5312h258141719H6726H21H3t14?17?1819?m1s1
MFCD03306117
N#CC1=C(N)C((C@H)((C@H)2C1=CC1CCC2N1C)c1ccc(cc1)Cl)(C#N)C#N
N#CC1=C(N)C(C((C@@H)2C1=CC1CCC2N1C)c1ccc(cc1)Cl)(C#N)C#N
ZINC000101146457
ZINC000227195415
Check stock
See real-time availability and sample size for STK790754 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.