Vitas-M small molecule compound

3-({2-bromo-4-[(1Z)-2-cyano-3-{[2-(1H-indol-3-yl)ethyl]amino}-3-oxoprop-1-en-1-yl]-6-ethoxyphenoxy}methyl)benzoic acid

Catalog ID
STK183165
SMILES CCOc1cc(/C=C(\C(=O)NCCc2c[nH]c3c2cccc3)/C#N)cc(c1OCc1cccc(c1)C(=O)O)Br

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 C30H26BrN3O5 MW 588.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H26BrN3O5/c1-2-38-27-15-20(14-25(31)28(27)39-18-19-6-5-7-21(12-19)30(36)37)13-23(16-32)29(35)33-11-10-22-17-34-26-9-4-3-8-24(22)26/h3-9,12-15,17,34H,2,10-11,18H2,1H3,(H,33,35)(H,36,37)/b23-13-
InChIKey
YIMSOAPBPNDHFF-QRVIBDJDSA-N
Synonyms

3((2BROMO4((1Z)2CYANO3((2(1HINDOL3YL)ETHYL)AMINO)3OXOPROP1EN1YL)6ETHOXYPHENOXY)METHYL)BENZOICACID
3((2BROMO4((Z)2CYANO3(2(1HINDOL3YL)ETHYLAMINO)3OXOPROP1ENYL)6ETHOXYPHENOXY)METHYL)BENZOICACID
CCOC1=C(C(=CC(=C1)C=C(C#N)C(=O)NCCC2=CNC3=CC=CC=C32)Br)OCC4=CC=CC(=C4)C(=O)O
CCOc1cc(C=C(C(=O)NCCc2c(nH)c3c2cccc3)C#N)cc(c1OCc1cccc(c1)C(=O)O)Br
InChI=1SC30H26BrN3O5c1238271520(1425(31)28(27)39181965721(1219)30(36)37)1323(1632)29(35)33111022173426943824(22)26h3912151734H2101118H21H3(H3335)(H3637)b2313
MFCD04563389
ZINC000097960745
ZINC97960745

Check stock

See real-time availability and sample size for STK183165 on the Vitas-M platform.

Check stock on Vitas-M

Available files

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