2-[(5-carboxy-1,3-benzothiazol-2-yl)disulfanyl]-1,3-benzothiazole-5-carboxylic acid

Systemtic Name: 2-[(5-carboxy-1,3-benzothiazol-2-yl)disulfanyl]-1,3-benzothiazole-5-carboxylic acid Openeye Name: 2-[(5-carboxy-1,3-benzothiazol-2-yl)disulfanyl]-1,3-benzothiazole-5-carboxylic acid CAS Name: 2-[(5-carboxy-1,3-benzothiazol-2-yl)disulfanyl]-1,3-benzothiazole-5-carboxylic acid IUPAC Name: 2-[(5-carboxy-1,3-benzothiazol-2-yl)disulfanyl]-1,3-benzothiazole-5-carboxylic acid Traditional Name: 2-[(5-carboxy-1,3-benzothiazol-2-yl)disulfanyl]-1,3-benzothiazole-5-carboxylic acid Formula: C16H8N2O4S4 MolecularWeight: 420.50572

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1C(=O)O)N=C(S2)SSC3=NC4=C(S3)C=CC(=C4)C(=O)O

Isomeric SMILES

C1=CC2=C(C=C1C(=O)O)N=C(S2)SSC3=NC4=C(S3)C=CC(=C4)C(=O)O

InChI

InChI=1S/C16H8N2O4S4/c19-13(20)7-1-3-11-9(5-7)17-15(23-11)25-26-16-18-10-6-8(14(21)22)2-4-12(10)24-16/h1-6H,(H,19,20)(H,21,22)