2-[(2-sulfanylidene-3H-1,3-benzothiazol-6-yl)carbamoyl]benzoic acid

Systemtic Name: 2-[(2-sulfanylidene-3H-1,3-benzothiazol-6-yl)carbamoyl]benzoic acid Openeye Name: 2-[(2-thioxo-3H-1,3-benzothiazol-6-yl)carbamoyl]benzoic acid CAS Name: 2-[oxo-[(2-sulfanylidene-3H-1,3-benzothiazol-6-yl)amino]methyl]benzoic acid IUPAC Name: 2-[(2-sulfanylidene-3H-1,3-benzothiazol-6-yl)carbamoyl]benzoic acid Traditional Name: 2-[(2-thioxo-3H-1,3-benzothiazol-6-yl)carbamoyl]benzoic acid Formula: C15H10N2O3S2 MolecularWeight: 330.3815

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)NC2=CC3=C(C=C2)NC(=S)S3)C(=O)O

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)NC2=CC3=C(C=C2)NC(=S)S3)C(=O)O

InChI

InChI=1S/C15H10N2O3S2/c18-13(9-3-1-2-4-10(9)14(19)20)16-8-5-6-11-12(7-8)22-15(21)17-11/h1-7H,(H,16,18)(H,17,21)(H,19,20)