Vitas-M small molecule compound
N-[(E)-{3-bromo-4-[2-(4-cyclohexylphenoxy)ethoxy]-5-ethoxyphenyl}methylidene]-4H-1,2,4-triazol-4-amine
Catalog ID
STK075419
SMILES CCOc1cc(/C=N/n2cnnc2)cc(c1OCCOc1ccc(cc1)C1CCCCC1)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 C25H29BrN4O3 MW 513.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H29BrN4O3/c1-2-31-24-15-19(16-29-30-17-27-28-18-30)14-23(26)25(24)33-13-12-32-22-10-8-21(9-11-22)20-6-4-3-5-7-20/h8-11,14-18,20H,2-7,12-13H2,1H3/b29-16+InChIKey
CGWUBXZDPGBHCV-MUFRIFMGSA-NSynonyms
(E)1(3bromo4(2(4cyclohexylphenoxy)ethoxy)5ethoxyphenyl)N(124triazol4yl)methanimine
1(3BROMO4(2(4CYCLOHEXYLPHENOXY)ETHOXY)5ETHOXYPHENYL)N(124TRIAZOL4YL)METHANIMINE
CCOC1=C(C(=CC(=C1)C=NN2C=NN=C2)Br)OCCOC3=CC=C(C=C3)C4CCCCC4
CCOc1cc(C=Nn2cnnc2)cc(c1OCCOc1ccc(cc1)C1CCCCC1)Br
InChI=1SC25H29BrN4O3c1231241519(1629301727281830)1423(26)25(24)331312322210821(91122)206435720h811141820H271213H21H3b2916+
MFCD02952520
N((E)(3BROMO4(2(4CYCLOHEXYLPHENOXY)ETHOXY)5ETHOXYPHENYL)METHYLIDENE)4H124TRIAZOL4AMINE
N(3BROMO4(2(4CYCLOHEXYLPHENOXY)ETHOXY)5ETHOXYBENZYLIDENE)N(4H124TRIAZOL4YL)AMINE
STK075419
ZINC000002149542
ZINC2149538
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