3-[2-[(E,3E)-3-(3-Ethyl-5-methoxy-1,3-benzothiazol-2-ylidene)-2-methoxyprop-1-enyl]-1,3-benzothiazol-3-ium-3-yl]propane-1-sulfonate (CHEBI:149982)

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CHEBI:149982 - 3-[2-[(E,3E)-3-(3-Ethyl-5-methoxy-1,3-benzothiazol-2-ylidene)-2-methoxyprop-1-enyl]-1,3-benzothiazol-3-ium-3-yl]propane-1-sulfonate

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ChEBI ID	CHEBI:149982
ChEBI Name	3-[2-[(E,3E)-3-(3-Ethyl-5-methoxy-1,3-benzothiazol-2-ylidene)-2-methoxyprop-1-enyl]-1,3-benzothiazol-3-ium-3-yl]propane-1-sulfonate
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Downloads	Molfile

Formula	C24H26N2O5S3
Net Charge	0
Average Mass	518.682
Monoisotopic Mass	518.10038
SMILES	CCN1/C(=C\C(=C/c2sc3ccccc3[n+]2CCCS(=O)(=O)[O-])OC)Sc2ccc(OC)cc21
InChI	InChI=1S/C24H26N2O5S3/c1-4-25-20-14-17(30-2)10-11-22(20)33-23(25)15-18(31-3)16-24-26(12-7-13-34(27,28)29)19-8-5-6-9-21(19)32-24/h5-6,8-11,14-16H,4,7,12-13H2,1-3H3
InChIKey	YGIKJGIQWDUYOD-UHFFFAOYSA-N

Roles Classification

Biological Role:

anticoronaviral agent Any antiviral agent which inhibits the activity of coronaviruses.

ChEBI Ontology

Outgoing Relation(s)
	3-[2-[(E,3E)-3-(3-Ethyl-5-methoxy-1,3-benzothiazol-2-ylidene)-2-methoxyprop-1-enyl]-1,3-benzothiazol-3-ium-3-yl]propane-1-sulfonate (CHEBI:149982) has role anticoronaviral agent (CHEBI:149553)
	3-[2-[(E,3E)-3-(3-Ethyl-5-methoxy-1,3-benzothiazol-2-ylidene)-2-methoxyprop-1-enyl]-1,3-benzothiazol-3-ium-3-yl]propane-1-sulfonate (CHEBI:149982) is a benzothiazoles (CHEBI:37947)