CHEBI:149995 - (2E)-3-Ethyl-2-[(2Z)-2-[[3-ethyl-6-[(E)-2-phenylethenyl]-1,3-benzothiazol-3-ium-2-yl]methylidene]butylidene]-5,6-dimethyl-1,3-benzothiazole;chloride

ChEBI IDCHEBI:149995
ChEBI Name(2E)-3-Ethyl-2-[(2Z)-2-[[3-ethyl-6-[(E)-2-phenylethenyl]-1,3-benzothiazol-3-ium-2-yl]methylidene]butylidene]-5,6-dimethyl-1,3-benzothiazole;chloride
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DownloadsMolfile
FormulaC33H35N2S2.Cl
Net Charge0
Average Mass559.244
Monoisotopic Mass558.19302
SMILESCCC(=C\c1sc2cc(C)c(C)cc2[n+]1CC)/C=C1/Sc2cc(/C=C/c3ccccc3)ccc2N1CC.[Cl-]
InChIInChI=1S/C33H35N2S2.ClH/c1-6-25(22-33-35(8-3)29-18-23(4)24(5)19-30(29)36-33)21-32-34(7-2)28-17-16-27(20-31(28)37-32)15-14-26-12-10-9-11-13-26;/h9-22H,6-8H2,1-5H3;1H/q+1;/p-1/b15-14+;
InChIKeyAMVJFNIDTMSNHR-WPDLWGESSA-M
Roles Classification
Biological Role:
anticoronaviral agent  Any antiviral agent which inhibits the activity of coronaviruses.
ChEBI Ontology
Outgoing Relation(s)
(2E)-3-Ethyl-2-[(2Z)-2-[[3-ethyl-6-[(E)-2-phenylethenyl]-1,3-benzothiazol-3-ium-2-yl]methylidene]butylidene]-5,6-dimethyl-1,3-benzothiazole;chloride (CHEBI:149995) has role anticoronaviral agent (CHEBI:149553)
(2E)-3-Ethyl-2-[(2Z)-2-[[3-ethyl-6-[(E)-2-phenylethenyl]-1,3-benzothiazol-3-ium-2-yl]methylidene]butylidene]-5,6-dimethyl-1,3-benzothiazole;chloride (CHEBI:149995) is a stilbenoid (CHEBI:26776)