Vitas-M small molecule compound

N-[(3Z)-3-(2-chloro-9H-thioxanthen-9-ylidene)propyl]-N,N-dimethylhexan-1-aminium

Catalog ID
STL036732
SMILES CCCCCC[N+](CC/C=C\1/c2ccccc2Sc2c1cc(Cl)cc2)(C)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 C24H31ClNS MW 401.04 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H31ClNS/c1-4-5-6-9-16-26(2,3)17-10-12-20-21-11-7-8-13-23(21)27-24-15-14-19(25)18-22(20)24/h7-8,11-15,18H,4-6,9-10,16-17H2,1-3H3/q+1/b20-12-
InChIKey
RRSXTIKDEOJZEX-NDENLUEZSA-N
Synonyms

((3Z)3(2CHLOROTHIOXANTHEN9YLIDENE)PROPYL)HEXYLDIMETHYLAZANIUM
(Z)N(3(2chloro9Hthioxanthen9ylidene)propyl)NNdimethylhexan1aminiumbromide
CCCCCC(N+)(C)(C)CCC=C1C2=CC=CC=C2SC3=C1C=C(C=C3)Cl
CCCCCC(N+)(CCC=C1c2ccccc2Sc2c1cc(Cl)cc2)(C)C
CCCCCC(N+)(CCC=C1c2ccccc2Sc2c1cc(Cl)cc2)(C)C(Br)
InChI=1SC24H31ClNSc145691626(23)171012202111781323(21)2724151419(25)1822(20)24h78111518H469101617H213H3q+1b2012
N((3Z)3(2chloro9Hthioxanthen9ylidene)propyl)NNdimethylhexan1aminium
ZINC000001816398
ZINC01816398
ZINC1816398

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Available files

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