ethyl 4-[[(4-fluoranyl-3-methyl-phenyl)sulfonyl-[(4-methylphenyl)methyl]amino]methyl]benzoate

Systemtic Name: ethyl 4-[[(4-fluoranyl-3-methyl-phenyl)sulfonyl-[(4-methylphenyl)methyl]amino]methyl]benzoate Openeye Name: ethyl 4-[[(4-fluoro-3-methyl-phenyl)sulfonyl-(p-tolylmethyl)amino]methyl]benzoate CAS Name: 4-[[(4-fluoro-3-methylphenyl)sulfonyl-[(4-methylphenyl)methyl]amino]methyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[(4-fluoro-3-methylphenyl)sulfonyl-[(4-methylphenyl)methyl]amino]methyl]benzoate Traditional Name: 4-[[(4-fluoro-3-methyl-phenyl)sulfonyl-(4-methylbenzyl)amino]methyl]benzoic acid ethyl ester Formula: C25H26FNO4S MolecularWeight: 455.541643

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)CN(CC2=CC=C(C=C2)C)S(=O)(=O)C3=CC(=C(C=C3)F)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)CN(CC2=CC=C(C=C2)C)S(=O)(=O)C3=CC(=C(C=C3)F)C

InChI

InChI=1S/C25H26FNO4S/c1-4-31-25(28)22-11-9-21(10-12-22)17-27(16-20-7-5-18(2)6-8-20)32(29,30)23-13-14-24(26)19(3)15-23/h5-15H,4,16-17H2,1-3H3