Vitas-M small molecule compound

diethyl 1-{2-[(3,5-dimethylphenyl)amino]-2-oxoethyl}-1H-1,2,3-triazole-4,5-dicarboxylate

Catalog ID
STL094527
SMILES CCOC(=O)c1n(nnc1C(=O)OCC)CC(=O)Nc1cc(C)cc(c1)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 C18H22N4O5 MW 374.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H22N4O5/c1-5-26-17(24)15-16(18(25)27-6-2)22(21-20-15)10-14(23)19-13-8-11(3)7-12(4)9-13/h7-9H,5-6,10H2,1-4H3,(H,19,23)
InChIKey
KHXOKSDKCATVEP-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=C(N(N=N1)CC(=O)NC2=CC(=CC(=C2)C)C)C(=O)OCC
diethyl1(2((35dimethylphenyl)amino)2oxoethyl)1H123triazole45dicarboxylate
diethyl1(2(35dimethylanilino)2oxoethyl)triazole45dicarboxylate
InChI=1SC18H22N4O5c152617(24)1516(18(25)2762)22(212015)1014(23)1913811(3)712(4)913h79H5610H214H3(H1923)
MFCD14726153
ZINC000004878130
ZINC4878130

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Available files

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