Vitas-M small molecule compound
N-{(E)-[4-(benzyloxy)-3-bromo-5-methoxyphenyl]methylidene}-4H-1,2,4-triazol-4-amine
Catalog ID
STK386261
SMILES COc1cc(/C=N/n2cnnc2)cc(c1OCc1ccccc1)Br
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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 C17H15BrN4O2 MW 387.24 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H15BrN4O2/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/h2-9,11-12H,10H2,1H3/b21-9+InChIKey
MVPAWHUYGSGNOE-ZVBGSRNCSA-NSynonyms
(E)1(3bromo5methoxy4phenylmethoxyphenyl)N(124triazol4yl)methanimine
COC1=C(C(=CC(=C1)C=NN2C=NN=C2)Br)OCC3=CC=CC=C3
COc1cc(C=Nn2cnnc2)cc(c1OCc1ccccc1)Br
InChI=1SC17H15BrN4O2c12316814(921221119201222)715(18)17(16)2410135324613h291112H10H21H3b219+
MFCD01029835
N((E)(4(BENZYLOXY)3BROMO5METHOXYPHENYL)METHYLIDENE)4H124TRIAZOL4AMINE
ZINC000005357478
ZINC33729449
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