Vitas-M small molecule compound
2-bromo-N-[2-(4-chlorophenyl)-6-methyl-2H-benzotriazol-5-yl]-5-nitrobenzamide
Catalog ID
STK081396
SMILES Clc1ccc(cc1)n1nc2c(n1)cc(c(c2)C)NC(=O)c1cc(ccc1Br)[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 C20H13BrClN5O3 MW 486.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H13BrClN5O3/c1-11-8-18-19(25-26(24-18)13-4-2-12(22)3-5-13)10-17(11)23-20(28)15-9-14(27(29)30)6-7-16(15)21/h2-10H,1H3,(H,23,28)InChIKey
JOOLEXXKKMMMIG-UHFFFAOYSA-NSynonyms
2BROMON(2(4CHLOROPHENYL)6METHYL2HBENZOTRIAZOL5YL)5NITROBENZAMIDE
2BROMON(2(4CHLOROPHENYL)6METHYLBENZOTRIAZOL5YL)5NITROBENZAMIDE
CC1=CC2=NN(N=C2C=C1NC(=O)C3=C(C=CC(=C3)(N+)(=O)(O))Br)C4=CC=C(C=C4)Cl
Clc1ccc(cc1)n1nc2c(n1)cc(c(c2)C)NC(=O)c1cc(ccc1Br)(N+)(=O)(O)
InChI=1SC20H13BrClN5O3c11181819(2526(2418)134212(22)3513)1017(11)2320(28)15914(27(29)30)6716(15)21h210H1H3(H2328)
MFCD02217855
STK081396
ZINC000001219193
ZINC01219193
ZINC1219193
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