Vitas-M small molecule compound

1-ethyl-3-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)-1H-pyrazol-4-amine

Catalog ID
STK510362
SMILES CCn1cc(c(n1)c1nnc2n1CCCCC2)N

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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 C12H18N6 MW 246.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H18N6/c1-2-17-8-9(13)11(16-17)12-15-14-10-6-4-3-5-7-18(10)12/h8H,2-7,13H2,1H3
InChIKey
KHRDXPTVJGLTBG-UHFFFAOYSA-N
Synonyms
1174852-58-4
1174852584
1ethyl3(6789tetrahydro5H(124)triazolo(43a)azepin3yl)1Hpyrazol4amine
1ethyl3(6789tetrahydro5H(124)triazolo(43a)azepin3yl)pyrazol4amine
3(5H6H7H8H9H124TRIAZOLO(45A)AZAPERHYDROEPIN3YL)1ETHYLPYRAZOLE4YLAMINE
CCN1C=C(C(=N1)C2=NN=C3N2CCCCC3)N
InChI=1SC12H18N6c121789(13)11(1617)121514106435718(10)12h8H2713H21H3
MFCD12405281
ZINC000035655669
ZINC35655669

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Available files

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