Vitas-M small molecule compound
5-amino-N-(1,3-benzodioxol-5-ylmethyl)-1-(5-bromo-2-methoxybenzyl)-1H-1,2,3-triazole-4-carboxamide
Catalog ID
STL094235
SMILES COc1ccc(cc1Cn1nnc(c1N)C(=O)NCc1ccc2c(c1)OCO2)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 C19H18BrN5O4 MW 460.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18BrN5O4/c1-27-14-5-3-13(20)7-12(14)9-25-18(21)17(23-24-25)19(26)22-8-11-2-4-15-16(6-11)29-10-28-15/h2-7H,8-10,21H2,1H3,(H,22,26)InChIKey
FSIOCCLINLLJPX-UHFFFAOYSA-NSynonyms
899737-92-95aminoN(13benzodioxol5ylmethyl)1((5bromo2methoxyphenyl)methyl)triazole4carboxamide
5aminoN(13benzodioxol5ylmethyl)1(5bromo2methoxybenzyl)1H123triazole4carboxamide
5AMINON(BENZO(D)(13)DIOXOL5YLMETHYL)1(5BROMO2METHOXYBENZYL)1H123TRIAZOLE4CARBOXAMIDE
899737929
COC1=C(C=C(C=C1)Br)CN2C(=C(N=N2)C(=O)NCC3=CC4=C(C=C3)OCO4)N
InChI=1SC19H18BrN5O4c127145313(20)712(14)92518(21)17(232425)19(26)22811241516(611)29102815h27H81021H21H3(H2226)
MFCD07650554
ZINC000009749170
ZINC09749170
ZINC9749170
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