Vitas-M small molecule compound

6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-ylacetonitrile

Catalog ID
STK731558
SMILES N#CCc1nnc2n1CCCCC2

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 C9H12N4 MW 176.22 g/mol Purity >90% as per NMR
InChI
InChI=1S/C9H12N4/c10-6-5-9-12-11-8-4-2-1-3-7-13(8)9/h1-5,7H2
InChIKey
PSFLXSYUOJMEQK-UHFFFAOYSA-N
Synonyms
116598-69-7
116598697
2(5H6H7H8H9H124TRIAZOLO(45A)AZAPERHYDROEPIN3YL)ETHANENITRILE
2(6789tetrahydro5H(124)triazolo(43a)azepin3yl)acetonitrile
6789tetrahydro5H(124)triazolo(43a)azepin3ylacetonitrile
C1CCC2=NN=C(N2CC1)CC#N
InChI=1SC9H12N4c10659121184213713(8)9h157H2
MFCD00980781
ZINC000003885173
ZINC03885173
ZINC3885173

Check stock

See real-time availability and sample size for STK731558 on the Vitas-M platform.

Check stock on Vitas-M

Available files

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