(3-fluorophenyl)methyl N-[[2-[1-[[2,5-bis(fluoranyl)phenyl]-(4-chlorophenyl)sulfonyl-amino]ethyl]phenyl]methyl]-N-[(3-fluorophenyl)methyl]carbamate

Systemtic Name: (3-fluorophenyl)methyl N-[[2-[1-[[2,5-bis(fluoranyl)phenyl]-(4-chlorophenyl)sulfonyl-amino]ethyl]phenyl]methyl]-N-[(3-fluorophenyl)methyl]carbamate Openeye Name: (3-fluorophenyl)methyl N-[[2-[1-(N-(4-chlorophenyl)sulfonyl-2,5-difluoro-anilino)ethyl]phenyl]methyl]-N-[(3-fluorophenyl)methyl]carbamate CAS Name: N-[[2-[1-(N-(4-chlorophenyl)sulfonyl-2,5-difluoroanilino)ethyl]phenyl]methyl]-N-[(3-fluorophenyl)methyl]carbamic acid (3-fluorophenyl)methyl ester IUPAC Name: (3-fluorophenyl)methyl N-[[2-[1-(N-(4-chlorophenyl)sulfonyl-2,5-difluoroanilino)ethyl]phenyl]methyl]-N-[(3-fluorophenyl)methyl]carbamate Traditional Name: N-[2-[1-(N-(4-chlorophenyl)sulfonyl-2,5-difluoro-anilino)ethyl]benzyl]-N-(3-fluorobenzyl)carbamic acid (3-fluorobenzyl) ester Formula: C36H29ClF4N2O4S MolecularWeight: 697.138073

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1CN(CC2=CC(=CC=C2)F)C(=O)OCC3=CC(=CC=C3)F)N(C4=C(C=CC(=C4)F)F)S(=O)(=O)C5=CC=C(C=C5)Cl

Isomeric SMILES

CC(C1=CC=CC=C1CN(CC2=CC(=CC=C2)F)C(=O)OCC3=CC(=CC=C3)F)N(C4=C(C=CC(=C4)F)F)S(=O)(=O)C5=CC=C(C=C5)Cl

InChI

InChI=1S/C36H29ClF4N2O4S/c1-24(43(35-20-31(40)14-17-34(35)41)48(45,46)32-15-12-28(37)13-16-32)33-11-3-2-8-27(33)22-42(21-25-6-4-9-29(38)18-25)36(44)47-23-26-7-5-10-30(39)19-26/h2-20,24H,21-23H2,1H3