4-[[3-(1,3-benzothiazol-2-yl)phenyl]sulfamoyl]benzoate

Systemtic Name: 4-[[3-(1,3-benzothiazol-2-yl)phenyl]sulfamoyl]benzoate Openeye Name: 4-[[3-(1,3-benzothiazol-2-yl)phenyl]sulfamoyl]benzoate CAS Name: 4-[[3-(1,3-benzothiazol-2-yl)phenyl]sulfamoyl]benzoate IUPAC Name: 4-[[3-(1,3-benzothiazol-2-yl)phenyl]sulfamoyl]benzoate Traditional Name: 4-[[3-(1,3-benzothiazol-2-yl)phenyl]sulfamoyl]benzoate Formula: C20H13N2O4S2- MolecularWeight: 409.45822

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)C3=CC(=CC=C3)NS(=O)(=O)C4=CC=C(C=C4)C(=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)C3=CC(=CC=C3)NS(=O)(=O)C4=CC=C(C=C4)C(=O)[O-]

InChI

InChI=1S/C20H14N2O4S2/c23-20(24)13-8-10-16(11-9-13)28(25,26)22-15-5-3-4-14(12-15)19-21-17-6-1-2-7-18(17)27-19/h1-12,22H,(H,23,24)/p-1