Vitas-M small molecule compound
N-(2-bromo-4-methylphenyl)-1-{2-[(3,4-dimethylphenyl)amino]-2-oxoethyl}-5-methyl-1H-1,2,3-triazole-4-carboxamide
Catalog ID
STL129557
SMILES Cc1ccc(c(c1)Br)NC(=O)c1nnn(c1C)CC(=O)Nc1ccc(c(c1)C)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 C21H22BrN5O2 MW 456.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22BrN5O2/c1-12-5-8-18(17(22)9-12)24-21(29)20-15(4)27(26-25-20)11-19(28)23-16-7-6-13(2)14(3)10-16/h5-10H,11H2,1-4H3,(H,23,28)(H,24,29)InChIKey
CWJYSPBIEHZKGP-UHFFFAOYSA-NSynonyms
CC1=CC(=C(C=C1)NC(=O)C2=C(N(N=N2)CC(=O)NC3=CC(=C(C=C3)C)C)C)Br
InChI=1SC21H22BrN5O2c1125818(17(22)912)2421(29)2015(4)27(262520)1119(28)23167613(2)14(3)1016h510H11H214H3(H2328)(H2429)
MFCD20747273
N(2bromo4methylphenyl)1(2((34dimethylphenyl)amino)2oxoethyl)5methyl1H123triazole4carboxamide
N(2bromo4methylphenyl)1(2(34dimethylanilino)2oxoethyl)5methyltriazole4carboxamide
ZINC000067322256
ZINC67322256
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