1-[[5,6-bis(chloranyl)-1,3-benzothiazol-2-yl]sulfanyl]anthracene-9,10-dione

Systemtic Name: 1-[[5,6-bis(chloranyl)-1,3-benzothiazol-2-yl]sulfanyl]anthracene-9,10-dione Openeye Name: 1-[(5,6-dichloro-1,3-benzothiazol-2-yl)sulfanyl]anthracene-9,10-dione CAS Name: 1-[(5,6-dichloro-1,3-benzothiazol-2-yl)thio]anthracene-9,10-dione IUPAC Name: 1-[(5,6-dichloro-1,3-benzothiazol-2-yl)sulfanyl]anthracene-9,10-dione Traditional Name: 1-[(5,6-dichloro-1,3-benzothiazol-2-yl)thio]-9,10-anthraquinone Formula: C21H9Cl2NO2S2 MolecularWeight: 442.33766

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=CC=C3)SC4=NC5=CC(=C(C=C5S4)Cl)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=CC=C3)SC4=NC5=CC(=C(C=C5S4)Cl)Cl

InChI

InChI=1S/C21H9Cl2NO2S2/c22-13-8-15-17(9-14(13)23)28-21(24-15)27-16-7-3-6-12-18(16)20(26)11-5-2-1-4-10(11)19(12)25/h1-9H