methyl 2-[2-[(4-fluorophenyl)methyl-(phenylsulfonyl)amino]ethanoylamino]benzoate

Systemtic Name: methyl 2-[2-[(4-fluorophenyl)methyl-(phenylsulfonyl)amino]ethanoylamino]benzoate Openeye Name: methyl 2-[[2-[benzenesulfonyl-[(4-fluorophenyl)methyl]amino]acetyl]amino]benzoate CAS Name: 2-[[2-[benzenesulfonyl-[(4-fluorophenyl)methyl]amino]-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[[2-[benzenesulfonyl-[(4-fluorophenyl)methyl]amino]acetyl]amino]benzoate Traditional Name: 2-[[2-[besyl-(4-fluorobenzyl)amino]acetyl]amino]benzoic acid methyl ester Formula: C23H21FN2O5S MolecularWeight: 456.486643

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1NC(=O)CN(CC2=CC=C(C=C2)F)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=CC=CC=C1NC(=O)CN(CC2=CC=C(C=C2)F)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C23H21FN2O5S/c1-31-23(28)20-9-5-6-10-21(20)25-22(27)16-26(15-17-11-13-18(24)14-12-17)32(29,30)19-7-3-2-4-8-19/h2-14H,15-16H2,1H3,(H,25,27)