Vitas-M small molecule compound
4-amino-1-[2-(4-chlorophenyl)-2-oxoethyl]-3,5-dimethyl-4H-1,2,4-triazol-1-ium
Catalog ID
STK664255
SMILES Clc1ccc(cc1)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 C12H14ClN4O MW 265.72 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H14ClN4O/c1-8-15-16(9(2)17(8)14)7-12(18)10-3-5-11(13)6-4-10/h3-6H,7,14H2,1-2H3/q+1InChIKey
LPEJOAQPFJNXAK-UHFFFAOYSA-NSynonyms
2(4AMINO35DIMETHYL124TRIAZOL4IUM1YL)1(4CHLOROPHENYL)ETHANONE
4amino1(2(4chlorophenyl)2oxoethyl)35dimethyl4H124triazol1ium
CC1=NN(C(=(N+)1N)C)CC(=O)C2=CC=C(C=C2)Cl
Clc1ccc(cc1)C(=O)C(n+)1nc(n(c1C)N)C
InChI=1SC12H14ClN4Oc181516(9(2)17(8)14)712(18)103511(13)6410h36H714H212H3q+1
ZINC000003209332
ZINC03209332
ZINC3209332
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