Vitas-M small molecule compound
N-[(3Z)-3-(2-chloro-9H-thioxanthen-9-ylidene)propyl]-N,N-dimethylbutan-1-aminium
Catalog ID
STL036734
SMILES CCCC[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 C22H27ClNS MW 372.98 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H27ClNS/c1-4-5-14-24(2,3)15-8-10-18-19-9-6-7-11-21(19)25-22-13-12-17(23)16-20(18)22/h6-7,9-13,16H,4-5,8,14-15H2,1-3H3/q+1/b18-10-InChIKey
QKFKWKFMYQHOMN-ZDLGFXPLSA-NSynonyms
(Z)N(3(2chloro9Hthioxanthen9ylidene)propyl)NNdimethylbutan1aminiumiodide
BUTYL((3Z)3(2CHLOROTHIOXANTHEN9YLIDENE)PROPYL)DIMETHYLAZANIUM
CCCC(N+)(C)(C)CCC=C1C2=CC=CC=C2SC3=C1C=C(C=C3)Cl
CCCC(N+)(CCC=C1c2ccccc2Sc2c1cc(Cl)cc2)(C)C
CCCC(N+)(CCC=C1c2ccccc2Sc2c1cc(Cl)cc2)(C)C(I)
InChI=1SC22H27ClNSc1451424(23)1581018199671121(19)2522131217(23)1620(18)22h6791316H4581415H213H3q+1b1810
N((3Z)3(2chloro9Hthioxanthen9ylidene)propyl)NNdimethylbutan1aminium
ZINC000001832090
ZINC01832090
ZINC1832090
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