Vitas-M small molecule compound

(3Z)-3-(2-chloro-9H-thioxanthen-9-ylidene)-N,N,N-trimethylpropan-1-aminium

Catalog ID
STL036728
SMILES Clc1ccc2c(c1)/C(=C\CC[N+](C)(C)C)/c1c(S2)cccc1

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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 C19H21ClNS MW 330.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H21ClNS/c1-21(2,3)12-6-8-15-16-7-4-5-9-18(16)22-19-11-10-14(20)13-17(15)19/h4-5,7-11,13H,6,12H2,1-3H3/q+1/b15-8-
InChIKey
MEGKGFLRLJLXDL-NVNXTCNLSA-N
Synonyms

((3Z)3(2CHLOROTHIOXANTHEN9YLIDENE)PROPYL)TRIMETHYLAZANIUM
(3Z)3(2chloro9Hthioxanthen9ylidene)NNNtrimethylpropan1aminium
(Z)3(2chloro9Hthioxanthen9ylidene)NNNtrimethylpropan1aminiumiodide
C(N+)(C)(C)CCC=C1C2=CC=CC=C2SC3=C1C=C(C=C3)Cl
Clc1ccc2c(c1)C(=CCC(N+)(C)(C)C)c1c(S2)cccc1
Clc1ccc2c(c1)C(=CCC(N+)(C)(C)C)c1c(S2)cccc1(I)
InChI=1SC19H21ClNSc121(23)12681516745918(16)2219111014(20)1317(15)19h4571113H612H213H3q+1b158
ZINC000000520423
ZINC00520423
ZINC520423

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Available files

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