Vitas-M small molecule compound
(1-ethyl-4-nitro-1H-pyrazol-3-yl)[(7Z)-7-(4-methylbenzylidene)-3-(4-methylphenyl)-3,3a,4,5,6,7-hexahydro-2H-indazol-2-yl]methanone
Catalog ID
STL395796
SMILES CCn1nc(c(c1)[N+](=O)[O-])C(=O)N1N=C2C(C1c1ccc(cc1)C)CCC/C/2=C/c1ccc(cc1)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 C28H29N5O3 MW 483.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H29N5O3/c1-4-31-17-24(33(35)36)26(29-31)28(34)32-27(21-14-10-19(3)11-15-21)23-7-5-6-22(25(23)30-32)16-20-12-8-18(2)9-13-20/h8-17,23,27H,4-7H2,1-3H3/b22-16-InChIKey
JUQKZCJFATZVTA-JWGURIENSA-NSynonyms
(1ethyl4nitro1Hpyrazol3yl)((7Z)7(4methylbenzylidene)3(4methylphenyl)33a4567hexahydro2Hindazol2yl)methanone
(1ethyl4nitropyrazol3yl)((7Z)3(4methylphenyl)7((4methylphenyl)methylidene)3a456tetrahydro3Hindazol2yl)methanone
CCN1C=C(C(=N1)C(=O)N2C(C3CCCC(=CC4=CC=C(C=C4)C)C3=N2)C5=CC=C(C=C5)C)(N+)(=O)(O)
CCn1nc(c(c1)(N+)(=O)(O))C(=O)N1N=C2C(C1c1ccc(cc1)C)CCCC2=Cc1ccc(cc1)C
InChI=1SC28H29N5O3c14311724(33(35)36)26(2931)28(34)3227(21141019(3)111521)2375622(25(23)3032)162012818(2)91320h8172327H47H213H3b2216
MFCD28952553
ZINC000004489214
ZINC000098087353
Check stock
See real-time availability and sample size for STL395796 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.