Vitas-M small molecule compound
5-amino-1-(5-bromo-2-methoxybenzyl)-N-(3,4-dimethoxybenzyl)-1H-1,2,3-triazole-4-carboxamide
Catalog ID
STL094240
SMILES COc1cc(CNC(=O)c2nnn(c2N)Cc2cc(Br)ccc2OC)ccc1OC
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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 C20H22BrN5O4 MW 476.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22BrN5O4/c1-28-15-7-5-14(21)9-13(15)11-26-19(22)18(24-25-26)20(27)23-10-12-4-6-16(29-2)17(8-12)30-3/h4-9H,10-11,22H2,1-3H3,(H,23,27)InChIKey
DCGCGPPXYWHCQR-UHFFFAOYSA-NSynonyms
899940-72-85amino1((5bromo2methoxyphenyl)methyl)N((34dimethoxyphenyl)methyl)triazole4carboxamide
5amino1(5bromo2methoxybenzyl)N(34dimethoxybenzyl)1H123triazole4carboxamide
899940728
COC1=C(C=C(C=C1)Br)CN2C(=C(N=N2)C(=O)NCC3=CC(=C(C=C3)OC)OC)N
InChI=1SC20H22BrN5O4c128157514(21)913(15)112619(22)18(242526)20(27)2310124616(292)17(812)303h49H101122H213H3(H2327)
MFCD07650561
ZINC000009749221
ZINC09749221
ZINC9749221
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