3-(1-naphthalen-2-ylethylamino)-5-sulfamoyl-4-thiophen-2-yl-benzoic acid

Systemtic Name: 3-(1-naphthalen-2-ylethylamino)-5-sulfamoyl-4-thiophen-2-yl-benzoic acid Openeye Name: 3-[1-(2-naphthyl)ethylamino]-5-sulfamoyl-4-(2-thienyl)benzoic acid CAS Name: 3-[1-(2-naphthalenyl)ethylamino]-5-sulfamoyl-4-thiophen-2-ylbenzoic acid IUPAC Name: 3-(1-naphthalen-2-ylethylamino)-5-sulfamoyl-4-thiophen-2-ylbenzoic acid Traditional Name: 3-[1-(2-naphthyl)ethylamino]-5-sulfamoyl-4-(2-thienyl)benzoic acid Formula: C23H20N2O4S2 MolecularWeight: 452.5459

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=CC=CC=C2C=C1)NC3=C(C(=CC(=C3)C(=O)O)S(=O)(=O)N)C4=CC=CS4

Isomeric SMILES

CC(C1=CC2=CC=CC=C2C=C1)NC3=C(C(=CC(=C3)C(=O)O)S(=O)(=O)N)C4=CC=CS4

InChI

InChI=1S/C23H20N2O4S2/c1-14(16-9-8-15-5-2-3-6-17(15)11-16)25-19-12-18(23(26)27)13-21(31(24,28)29)22(19)20-7-4-10-30-20/h2-14,25H,1H3,(H,26,27)(H2,24,28,29)