4-chloranyl-5-[(4-ethylphenyl)sulfamoyl]-2-(1-phenylbutylamino)benzoic acid

Systemtic Name: 4-chloranyl-5-[(4-ethylphenyl)sulfamoyl]-2-(1-phenylbutylamino)benzoic acid Openeye Name: 4-chloro-5-[(4-ethylphenyl)sulfamoyl]-2-(1-phenylbutylamino)benzoic acid CAS Name: 4-chloro-5-[(4-ethylphenyl)sulfamoyl]-2-(1-phenylbutylamino)benzoic acid IUPAC Name: 4-chloro-5-[(4-ethylphenyl)sulfamoyl]-2-(1-phenylbutylamino)benzoic acid Traditional Name: 4-chloro-5-[(4-ethylphenyl)sulfamoyl]-2-(1-phenylbutylamino)benzoic acid Formula: C25H27ClN2O4S MolecularWeight: 487.01088

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=CC=CC=C1)NC2=CC(=C(C=C2C(=O)O)S(=O)(=O)NC3=CC=C(C=C3)CC)Cl

Isomeric SMILES

CCCC(C1=CC=CC=C1)NC2=CC(=C(C=C2C(=O)O)S(=O)(=O)NC3=CC=C(C=C3)CC)Cl

InChI

InChI=1S/C25H27ClN2O4S/c1-3-8-22(18-9-6-5-7-10-18)27-23-16-21(26)24(15-20(23)25(29)30)33(31,32)28-19-13-11-17(4-2)12-14-19/h5-7,9-16,22,27-28H,3-4,8H2,1-2H3,(H,29,30)