Vitas-M small molecule compound
4-amino-1-[2-(2,4-dichlorophenyl)-2-oxoethyl]-3,5-dimethyl-4H-1,2,4-triazol-1-ium
Catalog ID
STL323266
SMILES Clc1ccc(c(c1)Cl)C(=O)C[n+]1nc(n(c1C)N)C
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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 C12H13Cl2N4O MW 300.17 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H13Cl2N4O/c1-7-16-17(8(2)18(7)15)6-12(19)10-4-3-9(13)5-11(10)14/h3-5H,6,15H2,1-2H3/q+1InChIKey
SAVZVCQSGWXFMY-UHFFFAOYSA-NSynonyms
2(4AMINO35DIMETHYL124TRIAZOL4IUM1YL)1(24DICHLOROPHENYL)ETHANONE
4amino1(2(24dichlorophenyl)2oxoethyl)35dimethyl4H124triazol1ium
4amino1(2(24dichlorophenyl)2oxoethyl)35dimethyl4H124triazol1iumbromide
CC1=NN(C(=(N+)1N)C)CC(=O)C2=C(C=C(C=C2)Cl)Cl
Clc1ccc(c(c1)Cl)C(=O)C(n+)1nc(n(c1C)N)C
Clc1ccc(c(c1)Cl)C(=O)C(n+)1nc(n(c1C)N)C(Br)
InChI=1SC12H13Cl2N4Oc171617(8(2)18(7)15)612(19)10439(13)511(10)14h35H615H212H3q+1
MFCD01088818
ZINC000013496610
ZINC13496610
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