Vitas-M small molecule compound
N-[1H-benzotriazol-1-yl(3,4-dimethoxyphenyl)methyl]-4-fluorobenzamide
Catalog ID
STL124701
SMILES COc1cc(ccc1OC)C(n1nnc2c1cccc2)NC(=O)c1ccc(cc1)F
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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 C22H19FN4O3 MW 406.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19FN4O3/c1-29-19-12-9-15(13-20(19)30-2)21(24-22(28)14-7-10-16(23)11-8-14)27-18-6-4-3-5-17(18)25-26-27/h3-13,21H,1-2H3,(H,24,28)InChIKey
LYDCLDOOSYNPMU-UHFFFAOYSA-NSynonyms
COC1=C(C=C(C=C1)C(NC(=O)C2=CC=C(C=C2)F)N3C4=CC=CC=C4N=N3)OC
InChI=1SC22H19FN4O3c1291912915(1320(19)302)21(2422(28)1471016(23)11814)2718643517(18)252627h31321H12H3(H2428)
MFCD02751022
N(1Hbenzotriazol1yl(34dimethoxyphenyl)methyl)4fluorobenzamide
N(benzotriazol1yl(34dimethoxyphenyl)methyl)4fluorobenzamide
ZINC000067240474
ZINC000067240476
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