Vitas-M small molecule compound
5-amino-1-(3-bromobenzyl)-N-(3,4-dimethoxyphenyl)-1H-1,2,3-triazole-4-carboxamide
Catalog ID
STL094162
SMILES COc1cc(ccc1OC)NC(=O)c1nnn(c1N)Cc1cccc(c1)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 C18H18BrN5O3 MW 432.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18BrN5O3/c1-26-14-7-6-13(9-15(14)27-2)21-18(25)16-17(20)24(23-22-16)10-11-4-3-5-12(19)8-11/h3-9H,10,20H2,1-2H3,(H,21,25)InChIKey
NPOHCTXZPKDEJK-UHFFFAOYSA-NSynonyms
1291836-92-41291836924
5amino1((3bromophenyl)methyl)N(34dimethoxyphenyl)triazole4carboxamide
5amino1(3bromobenzyl)N(34dimethoxyphenyl)1H123triazole4carboxamide
COC1=C(C=C(C=C1)NC(=O)C2=C(N(N=N2)CC3=CC(=CC=C3)Br)N)OC
InChI=1SC18H18BrN5O3c126147613(915(14)272)2118(25)1617(20)24(232216)101143512(19)811h39H1020H212H3(H2125)
MFCD18788087
ZINC000067240130
ZINC67240130
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