1-azanyl-4-(1,3-benzothiazol-2-ylsulfanyl)anthracene-9,10-dione

Systemtic Name: 1-azanyl-4-(1,3-benzothiazol-2-ylsulfanyl)anthracene-9,10-dione Openeye Name: 1-amino-4-(1,3-benzothiazol-2-ylsulfanyl)anthracene-9,10-dione CAS Name: 1-amino-4-(1,3-benzothiazol-2-ylthio)anthracene-9,10-dione IUPAC Name: 1-amino-4-(1,3-benzothiazol-2-ylsulfanyl)anthracene-9,10-dione Traditional Name: 1-amino-4-(1,3-benzothiazol-2-ylthio)-9,10-anthraquinone Formula: C21H12N2O2S2 MolecularWeight: 388.46218

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)C3=C(C=CC(=C3C2=O)SC4=NC5=CC=CC=C5S4)N

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)C3=C(C=CC(=C3C2=O)SC4=NC5=CC=CC=C5S4)N

InChI

InChI=1S/C21H12N2O2S2/c22-13-9-10-16(27-21-23-14-7-3-4-8-15(14)26-21)18-17(13)19(24)11-5-1-2-6-12(11)20(18)25/h1-10H,22H2