Vitas-M small molecule compound

(2E)-2-cyano-3-(6-nitro-1,3-benzodioxol-5-yl)-N-(pyridin-2-ylmethyl)prop-2-enamide

Catalog ID
STK462166
SMILES N#C/C(=C\c1cc2OCOc2cc1[N+](=O)[O-])/C(=O)NCc1ccccn1

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 C17H12N4O5 MW 352.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H12N4O5/c18-8-12(17(22)20-9-13-3-1-2-4-19-13)5-11-6-15-16(26-10-25-15)7-14(11)21(23)24/h1-7H,9-10H2,(H,20,22)/b12-5+
InChIKey
LLSXUHXJXSNPPY-LFYBBSHMSA-N
Synonyms

(2E)2CYANO3(6NITRO(2HBENZO(D)13DIOXOLAN5YL))N(2PYRIDYLMETHYL)PROP2ENAMIDE
(2E)2cyano3(6nitro13benzodioxol5yl)N(pyridin2ylmethyl)prop2enamide
(E)2cyano3(6nitro13benzodioxol5yl)N(pyridin2ylmethyl)prop2enamide
C1OC2=C(O1)C=C(C(=C2)C=C(C#N)C(=O)NCC3=CC=CC=N3)(N+)(=O)(O)
InChI=1SC17H12N4O5c18812(17(22)2091331241913)51161516(26102515)714(11)21(23)24h17H910H2(H2022)b125+
MFCD04255424
N#CC(=Cc1cc2OCOc2cc1(N+)(=O)(O))C(=O)NCc1ccccn1
ZINC000006644607
ZINC06644607
ZINC6644607

Check stock

See real-time availability and sample size for STK462166 on the Vitas-M platform.

Check stock on Vitas-M

Available files

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