3-[2-(6-cyanonaphthalen-2-yl)oxy-5-(methylsulfonylamino)phenyl]thiophene-2-carboxylic acid

Systemtic Name: 3-[2-(6-cyanonaphthalen-2-yl)oxy-5-(methylsulfonylamino)phenyl]thiophene-2-carboxylic acid Openeye Name: 3-[2-[(6-cyano-2-naphthyl)oxy]-5-(methanesulfonamido)phenyl]thiophene-2-carboxylic acid CAS Name: 3-[2-[(6-cyano-2-naphthalenyl)oxy]-5-(methanesulfonamido)phenyl]-2-thiophenecarboxylic acid IUPAC Name: 3-[2-(6-cyanonaphthalen-2-yl)oxy-5-(methanesulfonamido)phenyl]thiophene-2-carboxylic acid Traditional Name: 3-[2-(6-cyano-2-naphthoxy)-5-(methanesulfonamido)phenyl]-2-thenoic acid Formula: C23H16N2O5S2 MolecularWeight: 464.51354

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NC1=CC(=C(C=C1)OC2=CC3=C(C=C2)C=C(C=C3)C#N)C4=C(SC=C4)C(=O)O

Isomeric SMILES

CS(=O)(=O)NC1=CC(=C(C=C1)OC2=CC3=C(C=C2)C=C(C=C3)C#N)C4=C(SC=C4)C(=O)O

InChI

InChI=1S/C23H16N2O5S2/c1-32(28,29)25-17-5-7-21(20(12-17)19-8-9-31-22(19)23(26)27)30-18-6-4-15-10-14(13-24)2-3-16(15)11-18/h2-12,25H,1H3,(H,26,27)