Vitas-M small molecule compound
N-(1-benzofuran-2-ylmethyl)-N,N,N'-triethyl-N',N'-dimethylpentane-1,5-diaminium
Catalog ID
STL043311
SMILES CC[N+](Cc1cc2c(o1)cccc2)(CCCCC[N+](CC)(C)C)CC
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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 C22H38N2O MW 346.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H38N2O/c1-6-23(4,5)16-12-9-13-17-24(7-2,8-3)19-21-18-20-14-10-11-15-22(20)25-21/h10-11,14-15,18H,6-9,12-13,16-17,19H2,1-5H3/q+2InChIKey
GHSWKUBUGIUNQL-UHFFFAOYSA-NSynonyms
1BENZOFURAN2YLMETHYLDIETHYL(5(ETHYL(DIMETHYL)AZANIUMYL)PENTYL)AZANIUM
CC(N+)(C)(C)CCCCC(N+)(CC)(CC)CC1=CC2=CC=CC=C2O1
CC(N+)(Cc1cc2c(o1)cccc2)(CCCCC(N+)(CC)(C)C)CC
CC(N+)(Cc1cc2c(o1)cccc2)(CCCCC(N+)(CC)(C)C)CC(I)(I)
InChI=1SC22H38N2Oc1623(45)16129131724(7283)192118201410111522(20)2521h1011141518H691213161719H215H3q+2
N(1benzofuran2ylmethyl)NNNtriethylNNdimethylpentane15diaminium
N1(benzofuran2ylmethyl)N1N1N5triethylN5N5dimethylpentane15diaminiumiodide
ZINC000001829159
ZINC01829159
ZINC1829159
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