Vitas-M small molecule compound
N,N-diethyl-N-methyl-4-(thianthren-2-yl)but-2-yn-1-aminium
Catalog ID
STL112769
SMILES CC[N+](CC#CCc1ccc2c(c1)Sc1c(S2)cccc1)(CC)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 C21H24NS2 MW 354.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24NS2/c1-4-22(3,5-2)15-9-8-10-17-13-14-20-21(16-17)24-19-12-7-6-11-18(19)23-20/h6-7,11-14,16H,4-5,10,15H2,1-3H3/q+1InChIKey
XRXUJHRRXOEIAA-UHFFFAOYSA-NSynonyms
CC(N+)(C)(CC)CC#CCC1=CC2=C(C=C1)SC3=CC=CC=C3S2
CC(N+)(CC#CCc1ccc2c(c1)Sc1c(S2)cccc1)(CC)C
diethylmethyl(4thianthren2ylbut2ynyl)azanium
InChI=1SC21H24NS2c1422(352)1598101713142021(1617)241912761118(19)2320h67111416H451015H213H3q+1
NNdiethylNmethyl4(thianthren2yl)but2yn1aminium
ZINC000067319241
ZINC67319241
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