butyl 4-[[4-[(4-chlorophenyl)carbonylamino]-3-fluoranyl-phenyl]sulfonylamino]benzoate

Systemtic Name: butyl 4-[[4-[(4-chlorophenyl)carbonylamino]-3-fluoranyl-phenyl]sulfonylamino]benzoate Openeye Name: butyl 4-[[4-[(4-chlorobenzoyl)amino]-3-fluoro-phenyl]sulfonylamino]benzoate CAS Name: 4-[[4-[[(4-chlorophenyl)-oxomethyl]amino]-3-fluorophenyl]sulfonylamino]benzoic acid butyl ester IUPAC Name: butyl 4-[[4-[(4-chlorobenzoyl)amino]-3-fluorophenyl]sulfonylamino]benzoate Traditional Name: 4-[[4-[(4-chlorobenzoyl)amino]-3-fluoro-phenyl]sulfonylamino]benzoic acid butyl ester Formula: C24H22ClFN2O5S MolecularWeight: 504.958283

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NS(=O)(=O)C2=CC(=C(C=C2)NC(=O)C3=CC=C(C=C3)Cl)F

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NS(=O)(=O)C2=CC(=C(C=C2)NC(=O)C3=CC=C(C=C3)Cl)F

InChI

InChI=1S/C24H22ClFN2O5S/c1-2-3-14-33-24(30)17-6-10-19(11-7-17)28-34(31,32)20-12-13-22(21(26)15-20)27-23(29)16-4-8-18(25)9-5-16/h4-13,15,28H,2-3,14H2,1H3,(H,27,29)