2-[[3-(6-methylsulfonylpyridazin-3-yl)phenyl]carbamoyl]benzoic acid

Systemtic Name: 2-[[3-(6-methylsulfonylpyridazin-3-yl)phenyl]carbamoyl]benzoic acid Openeye Name: 2-[[3-(6-methylsulfonylpyridazin-3-yl)phenyl]carbamoyl]benzoic acid CAS Name: 2-[[3-(6-methylsulfonyl-3-pyridazinyl)anilino]-oxomethyl]benzoic acid IUPAC Name: 2-[[3-(6-methylsulfonylpyridazin-3-yl)phenyl]carbamoyl]benzoic acid Traditional Name: 2-[[3-(6-mesylpyridazin-3-yl)phenyl]carbamoyl]benzoic acid Formula: C19H15N3O5S MolecularWeight: 397.4045

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=NN=C(C=C1)C2=CC(=CC=C2)NC(=O)C3=CC=CC=C3C(=O)O

Isomeric SMILES

CS(=O)(=O)C1=NN=C(C=C1)C2=CC(=CC=C2)NC(=O)C3=CC=CC=C3C(=O)O

InChI

InChI=1S/C19H15N3O5S/c1-28(26,27)17-10-9-16(21-22-17)12-5-4-6-13(11-12)20-18(23)14-7-2-3-8-15(14)19(24)25/h2-11H,1H3,(H,20,23)(H,24,25)