methyl 5-[[(2-chlorophenyl)methyl-(4-methylphenyl)sulfonyl-amino]methyl]furan-2-carboxylate

Systemtic Name: methyl 5-[[(2-chlorophenyl)methyl-(4-methylphenyl)sulfonyl-amino]methyl]furan-2-carboxylate Openeye Name: methyl 5-[[(2-chlorophenyl)methyl-(p-tolylsulfonyl)amino]methyl]furan-2-carboxylate CAS Name: 5-[[(2-chlorophenyl)methyl-(4-methylphenyl)sulfonylamino]methyl]-2-furancarboxylic acid methyl ester IUPAC Name: methyl 5-[[(2-chlorophenyl)methyl-(4-methylphenyl)sulfonylamino]methyl]furan-2-carboxylate Traditional Name: 5-[[(2-chlorobenzyl)-tosyl-amino]methyl]furan-2-carboxylic acid methyl ester Formula: C21H20ClNO5S MolecularWeight: 433.9052

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CC2=CC=CC=C2Cl)CC3=CC=C(O3)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CC2=CC=CC=C2Cl)CC3=CC=C(O3)C(=O)OC

InChI

InChI=1S/C21H20ClNO5S/c1-15-7-10-18(11-8-15)29(25,26)23(13-16-5-3-4-6-19(16)22)14-17-9-12-20(28-17)21(24)27-2/h3-12H,13-14H2,1-2H3