Vitas-M small molecule compound

N-[2-(benzyloxy)benzyl]-4H-1,2,4-triazol-3-amine

Catalog ID
STK285870
SMILES c1ccc(cc1)COc1ccccc1CNc1nnc[nH]1

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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 C16H16N4O MW 280.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16N4O/c1-2-6-13(7-3-1)11-21-15-9-5-4-8-14(15)10-17-16-18-12-19-20-16/h1-9,12H,10-11H2,(H2,17,18,19,20)
InChIKey
ODZZKPYFKWKQHU-UHFFFAOYSA-N
Synonyms
861438-30-4
861438304
C1=CC=C(C=C1)COC2=CC=CC=C2CNC3=NC=NN3
c1ccc(cc1)COc1ccccc1CNc1nnc(nH)1
InChI=1SC16H16N4Oc12613(731)112115954814(15)1017161812192016h1912H1011H2(H217181920)
MFCD07610995
N((2phenylmethoxyphenyl)methyl)1H124triazol5amine
N(2(benzyloxy)benzyl)4H124triazol3amine
ZINC000013943037
ZINC13943037

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Available files

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