Vitas-M small molecule compound

N-[4-(benzyloxy)-3-chloro-5-methoxybenzyl]-4H-1,2,4-triazol-4-amine

Catalog ID
STK257494
SMILES COc1cc(CNn2cnnc2)cc(c1OCc1ccccc1)Cl

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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 C17H17ClN4O2 MW 344.80 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17ClN4O2/c1-23-16-8-14(9-21-22-11-19-20-12-22)7-15(18)17(16)24-10-13-5-3-2-4-6-13/h2-8,11-12,21H,9-10H2,1H3
InChIKey
IAIGHSFTYQUQRK-UHFFFAOYSA-N
Synonyms

COC1=C(C(=CC(=C1)CNN2C=NN=C2)Cl)OCC3=CC=CC=C3
InChI=1SC17H17ClN4O2c12316814(921221119201222)715(18)17(16)2410135324613h28111221H910H21H3
MFCD07173858
N((3CHLORO5METHOXY4PHENYLMETHOXYPHENYL)METHYL)124TRIAZOL4AMINE
N(4(BENZYLOXY)3CHLORO5METHOXYBENZYL)4H124TRIAZOL4AMINE
ZINC000007602500
ZINC07602500
ZINC7602500

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Available files

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