Vitas-M small molecule compound
N-[2-(4-ethoxyphenyl)-2H-benzotriazol-5-yl]-2-methyl-3-nitrobenzamide
Catalog ID
STL378135
SMILES CCOc1ccc(cc1)n1nc2c(n1)cc(cc2)NC(=O)c1cccc(c1C)[N+](=O)[O-]
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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 C22H19N5O4 MW 417.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19N5O4/c1-3-31-17-10-8-16(9-11-17)26-24-19-12-7-15(13-20(19)25-26)23-22(28)18-5-4-6-21(14(18)2)27(29)30/h4-13H,3H2,1-2H3,(H,23,28)InChIKey
OZBYCLOXMDYRPK-UHFFFAOYSA-NSynonyms
CCOC1=CC=C(C=C1)N2N=C3C=CC(=CC3=N2)NC(=O)C4=C(C(=CC=C4)(N+)(=O)(O))C
CCOc1ccc(cc1)n1nc2c(n1)cc(cc2)NC(=O)c1cccc(c1C)(N+)(=O)(O)
InChI=1SC22H19N5O4c13311710816(91117)26241912715(1320(19)2526)2322(28)1854621(14(18)2)27(29)30h413H3H212H3(H2328)
MFCD02640074
N(2(4ethoxyphenyl)2Hbenzotriazol5yl)2methyl3nitrobenzamide
N(2(4ETHOXYPHENYL)BENZOTRIAZOL5YL)2METHYL3NITROBENZAMIDE
ZINC000002979615
ZINC02979615
ZINC2979615
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