2-azanyl-5-(1,3-benzothiazol-2-yl)benzenesulfonic acid

Systemtic Name: 2-azanyl-5-(1,3-benzothiazol-2-yl)benzenesulfonic acid Openeye Name: 2-amino-5-(1,3-benzothiazol-2-yl)benzenesulfonic acid CAS Name: 2-amino-5-(1,3-benzothiazol-2-yl)benzenesulfonic acid IUPAC Name: 2-amino-5-(1,3-benzothiazol-2-yl)benzenesulfonic acid Traditional Name: 2-amino-5-(1,3-benzothiazol-2-yl)besylic acid Formula: C13H10N2O3S2 MolecularWeight: 306.3601

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)C3=CC(=C(C=C3)N)S(=O)(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)C3=CC(=C(C=C3)N)S(=O)(=O)O

InChI

InChI=1S/C13H10N2O3S2/c14-9-6-5-8(7-12(9)20(16,17)18)13-15-10-3-1-2-4-11(10)19-13/h1-7H,14H2,(H,16,17,18)