Vitas-M small molecule compound
N-(4-bromo-3-methylphenyl)-1-{2-[(3-chloro-4-methoxyphenyl)amino]-2-oxoethyl}-5-methyl-1H-1,2,3-triazole-4-carboxamide
Catalog ID
STL142885
SMILES COc1ccc(cc1Cl)NC(=O)Cn1nnc(c1C)C(=O)Nc1ccc(c(c1)C)Br
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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 C20H19BrClN5O3 MW 492.76 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19BrClN5O3/c1-11-8-13(4-6-15(11)21)24-20(29)19-12(2)27(26-25-19)10-18(28)23-14-5-7-17(30-3)16(22)9-14/h4-9H,10H2,1-3H3,(H,23,28)(H,24,29)InChIKey
VBRUZDKFYFZVKQ-UHFFFAOYSA-NSynonyms
CC1=C(C=CC(=C1)NC(=O)C2=C(N(N=N2)CC(=O)NC3=CC(=C(C=C3)OC)Cl)C)Br
InChI=1SC20H19BrClN5O3c111813(4615(11)21)2420(29)1912(2)27(262519)1018(28)23145717(303)16(22)914h49H10H213H3(H2328)(H2429)
MFCD20747598
N(4bromo3methylphenyl)1(2((3chloro4methoxyphenyl)amino)2oxoethyl)5methyl1H123triazole4carboxamide
N(4bromo3methylphenyl)1(2(3chloro4methoxyanilino)2oxoethyl)5methyltriazole4carboxamide
ZINC000071327226
ZINC71327226
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