Vitas-M small molecule compound
3-(4-bromophenyl)-1-ethyl-5-(pyrrolidin-1-yl)-1,2,4-triazin-1-ium
Catalog ID
STL342051
SMILES CC[n+]1cc(nc(n1)c1ccc(cc1)Br)N1CCCC1
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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 C15H18BrN4 MW 334.24 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H18BrN4/c1-2-20-11-14(19-9-3-4-10-19)17-15(18-20)12-5-7-13(16)8-6-12/h5-8,11H,2-4,9-10H2,1H3/q+1InChIKey
OQWHMTNNZDNUDD-UHFFFAOYSA-NSynonyms
3(4bromophenyl)1ethyl5(pyrrolidin1yl)124triazin1ium
3(4bromophenyl)1ethyl5(pyrrolidin1yl)124triazin1iumbromide
3(4BROMOPHENYL)1ETHYL5PYRROLIDIN1YL124TRIAZIN1IUM
CC(N+)1=NC(=NC(=C1)N2CCCC2)C3=CC=C(C=C3)Br
CC(n+)1cc(nc(n1)c1ccc(cc1)Br)N1CCCC1
CC(n+)1cc(nc(n1)c1ccc(cc1)Br)N1CCCC1(Br)
InChI=1SC15H18BrN4c12201114(199341019)1715(1820)125713(16)8612h5811H24910H21H3q+1
MFCD04032174
ZINC000005119144
ZINC05119144
ZINC5119144
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