Vitas-M small molecule compound

N-[(E)-(4-{2-[4-(hexyloxy)phenoxy]ethoxy}phenyl)methylidene]-4H-1,2,4-triazol-4-amine

Catalog ID
STK380476
SMILES CCCCCCOc1ccc(cc1)OCCOc1ccc(cc1)/C=N/n1cnnc1

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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 C23H28N4O3 MW 408.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H28N4O3/c1-2-3-4-5-14-28-22-10-12-23(13-11-22)30-16-15-29-21-8-6-20(7-9-21)17-26-27-18-24-25-19-27/h6-13,17-19H,2-5,14-16H2,1H3/b26-17+
InChIKey
ZKDMMNCULASKLE-YZSQISJMSA-N
Synonyms

(E)1(4(2(4hexoxyphenoxy)ethoxy)phenyl)N(124triazol4yl)methanimine
1(2(4((1E)2(124TRIAZOL4YL)2AZAVINYL)PHENOXY)ETHOXY)4HEXYLOXYBENZENE
CCCCCCOC1=CC=C(C=C1)OCCOC2=CC=C(C=C2)C=NN3C=NN=C3
CCCCCCOc1ccc(cc1)OCCOc1ccc(cc1)C=Nn1cnnc1
InChI=1SC23H28N4O3c12345142822101223(131122)30161529218620(7921)1726271824251927h6131719H251416H21H3b2617+
MFCD02126519
N((E)(4(2(4(hexyloxy)phenoxy)ethoxy)phenyl)methylidene)4H124triazol4amine
ZINC000004512411
ZINC33417275

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Available files

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