Vitas-M small molecule compound

6,6',7,7',8,8',9,9'-octahydro-5H,5'H-3,3'-bi[1,2,4]triazolo[4,3-a]azepine

Catalog ID
STK830471
SMILES C1CCn2c(CC1)nnc2c1nnc2n1CCCCC2

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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 C14H20N6 MW 272.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H20N6/c1-3-7-11-15-17-13(19(11)9-5-1)14-18-16-12-8-4-2-6-10-20(12)14/h1-10H2
InChIKey
SMFCVFMPWXTVOQ-UHFFFAOYSA-N
Synonyms
307325-26-4
3(5H6H7H8H9H124TRIAZOLO(45A)AZAPERHYDROEPIN3YL)5H6H7H8H9H124TRIAZOLO(43A)AZAPERHYDROEPINE
3(6789tetrahydro5H(124)triazolo(43a)azepin3yl)6789tetrahydro5H(124)triazolo(43a)azepine
307325264
66778899octahydro5H5H33bi(124)triazolo(43a)azepine
C1CCC2=NN=C(N2CC1)C3=NN=C4N3CCCCC4
InChI=1SC14H20N6c13711151713(19(11)951)1418161284261020(12)14h110H2
MFCD01419733
ZINC000004086305
ZINC04086305
ZINC4086305

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Available files

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