Vitas-M small molecule compound

ethyl 5-(benzyloxy)-1-{[(Z)-(4-methylphenyl)methylidene]amino}-1H-1,2,3-triazole-4-carboxylate

Catalog ID
STL437131
SMILES CCOC(=O)c1nnn(c1OCc1ccccc1)/N=C\c1ccc(cc1)C

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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 C20H20N4O3 MW 364.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20N4O3/c1-3-26-20(25)18-19(27-14-17-7-5-4-6-8-17)24(23-22-18)21-13-16-11-9-15(2)10-12-16/h4-13H,3,14H2,1-2H3/b21-13-
InChIKey
YCDDITMCXVJCAP-BKUYFWCQSA-N
Synonyms

CCOC(=O)C1=C(N(N=N1)N=CC2=CC=C(C=C2)C)OCC3=CC=CC=C3
CCOC(=O)c1nnn(c1OCc1ccccc1)N=Cc1ccc(cc1)C
ETHYL1((Z)(4METHYLPHENYL)METHYLIDENEAMINO)5PHENYLMETHOXYTRIAZOLE4CARBOXYLATE
ethyl5(benzyloxy)1(((Z)(4methylphenyl)methylidene)amino)1H123triazole4carboxylate
InChI=1SC20H20N4O3c132620(25)1819(2714177546817)24(232218)21131611915(2)101216h413H314H212H3b2113
MFCD06242976
ZINC000033338124
ZINC1418403

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Available files

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