Vitas-M small molecule compound

4-amino-1-[2-(2,4-dichlorophenyl)-2-oxoethyl]-1H-1,2,4-triazol-4-ium

Catalog ID
STL058878
SMILES Clc1ccc(c(c1)Cl)C(=O)Cn1nc[n+](c1)N

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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 C10H9Cl2N4O MW 272.11 g/mol Purity >90% as per NMR
InChI
InChI=1S/C10H9Cl2N4O/c11-7-1-2-8(9(12)3-7)10(17)4-16-6-15(13)5-14-16/h1-3,5-6H,4,13H2/q+1
InChIKey
LSSSZQFDFRPCBE-UHFFFAOYSA-N
Synonyms

2(4AMINO124TRIAZOL4IUM1YL)1(24DICHLOROPHENYL)ETHANONE
4AMINO1(2(24DICHLOROPHENYL)2OXOETHYL)1H(124)TRIAZOL4IUM
4amino1(2(24dichlorophenyl)2oxoethyl)1H124triazol4ium
4amino1(2(24dichlorophenyl)2oxoethyl)1H124triazol4iumbromide
C1=CC(=C(C=C1Cl)Cl)C(=O)CN2C=(N+)(C=N2)N
Clc1ccc(c(c1)Cl)C(=O)Cn1nc(n+)(c1)N
Clc1ccc(c(c1)Cl)C(=O)Cn1nc(n+)(c1)N(Br)
InChI=1SC10H9Cl2N4Oc117128(9(12)37)10(17)416615(13)51416h1356H413H2q+1
ZINC000000037825
ZINC00037825
ZINC37825

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Available files

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