2-[[3-(1,3-benzothiazol-2-yl)phenyl]carbamoyl]benzoic acid

Systemtic Name: 2-[[3-(1,3-benzothiazol-2-yl)phenyl]carbamoyl]benzoic acid Openeye Name: 2-[[3-(1,3-benzothiazol-2-yl)phenyl]carbamoyl]benzoic acid CAS Name: 2-[[3-(1,3-benzothiazol-2-yl)anilino]-oxomethyl]benzoic acid IUPAC Name: 2-[[3-(1,3-benzothiazol-2-yl)phenyl]carbamoyl]benzoic acid Traditional Name: 2-[[3-(1,3-benzothiazol-2-yl)phenyl]carbamoyl]benzoic acid Formula: C21H14N2O3S MolecularWeight: 374.41246

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)NC2=CC=CC(=C2)C3=NC4=CC=CC=C4S3)C(=O)O

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)NC2=CC=CC(=C2)C3=NC4=CC=CC=C4S3)C(=O)O

InChI

InChI=1S/C21H14N2O3S/c24-19(15-8-1-2-9-16(15)21(25)26)22-14-7-5-6-13(12-14)20-23-17-10-3-4-11-18(17)27-20/h1-12H,(H,22,24)(H,25,26)