2-[(3,4-dichlorophenyl)methyl-(4-methylphenyl)sulfonyl-amino]-N-(pyridin-3-ylmethyl)ethanamide

Systemtic Name: 2-[(3,4-dichlorophenyl)methyl-(4-methylphenyl)sulfonyl-amino]-N-(pyridin-3-ylmethyl)ethanamide Openeye Name: 2-[(3,4-dichlorophenyl)methyl-(p-tolylsulfonyl)amino]-N-(3-pyridylmethyl)acetamide CAS Name: 2-[(3,4-dichlorophenyl)methyl-(4-methylphenyl)sulfonylamino]-N-(3-pyridinylmethyl)acetamide IUPAC Name: 2-[(3,4-dichlorophenyl)methyl-(4-methylphenyl)sulfonylamino]-N-(pyridin-3-ylmethyl)acetamide Traditional Name: 2-[(3,4-dichlorobenzyl)-tosyl-amino]-N-(3-pyridylmethyl)acetamide Formula: C22H21Cl2N3O3S MolecularWeight: 478.39144

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CC2=CC(=C(C=C2)Cl)Cl)CC(=O)NCC3=CN=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CC2=CC(=C(C=C2)Cl)Cl)CC(=O)NCC3=CN=CC=C3

InChI

InChI=1S/C22H21Cl2N3O3S/c1-16-4-7-19(8-5-16)31(29,30)27(14-17-6-9-20(23)21(24)11-17)15-22(28)26-13-18-3-2-10-25-12-18/h2-12H,13-15H2,1H3,(H,26,28)