2-oxidanyl-4-[(2-sulfanylidene-3H-benzimidazol-1-yl)methylamino]benzoic acid

Systemtic Name: 2-oxidanyl-4-[(2-sulfanylidene-3H-benzimidazol-1-yl)methylamino]benzoic acid Openeye Name: 2-hydroxy-4-[(2-thioxo-3H-benzimidazol-1-yl)methylamino]benzoic acid CAS Name: 2-hydroxy-4-[(2-sulfanylidene-3H-benzimidazol-1-yl)methylamino]benzoic acid IUPAC Name: 2-hydroxy-4-[(2-sulfanylidene-3H-benzimidazol-1-yl)methylamino]benzoic acid Traditional Name: 2-hydroxy-4-[(2-thioxo-3H-benzimidazol-1-yl)methylamino]benzoic acid Formula: C15H13N3O3S MolecularWeight: 315.34702

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=S)N2CNC3=CC(=C(C=C3)C(=O)O)O

Isomeric SMILES

C1=CC=C2C(=C1)NC(=S)N2CNC3=CC(=C(C=C3)C(=O)O)O

InChI

InChI=1S/C15H13N3O3S/c19-13-7-9(5-6-10(13)14(20)21)16-8-18-12-4-2-1-3-11(12)17-15(18)22/h1-7,16,19H,8H2,(H,17,22)(H,20,21)