Vitas-M small molecule compound

5-amino-1-(3-bromophenyl)-N-(3-chloro-4-methoxyphenyl)-1H-1,2,3-triazole-4-carboxamide

Catalog ID
STL009989
SMILES COc1ccc(cc1Cl)NC(=O)c1nnn(c1N)c1cccc(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 C16H13BrClN5O2 MW 422.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H13BrClN5O2/c1-25-13-6-5-10(8-12(13)18)20-16(24)14-15(19)23(22-21-14)11-4-2-3-9(17)7-11/h2-8H,19H2,1H3,(H,20,24)
InChIKey
NLDKHHGSNRHKDI-UHFFFAOYSA-N
Synonyms
929820-44-0
5amino1(3bromophenyl)N(3chloro4methoxyphenyl)1H123triazole4carboxamide
5amino1(3bromophenyl)N(3chloro4methoxyphenyl)triazole4carboxamide
929820440
COC1=C(C=C(C=C1)NC(=O)C2=C(N(N=N2)C3=CC(=CC=C3)Br)N)Cl
InChI=1SC16H13BrClN5O2c125136510(812(13)18)2016(24)1415(19)23(222114)114239(17)711h28H19H21H3(H2024)
MFCD09845066
ZINC000009485449
ZINC09485449
ZINC9485449

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Available files

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