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

Systemtic Name: 2-[(2,4-dichlorophenyl)methyl-(4-methylphenyl)sulfonyl-amino]-N-(pyridin-4-ylmethyl)ethanamide Openeye Name: 2-[(2,4-dichlorophenyl)methyl-(p-tolylsulfonyl)amino]-N-(4-pyridylmethyl)acetamide CAS Name: 2-[(2,4-dichlorophenyl)methyl-(4-methylphenyl)sulfonylamino]-N-(pyridin-4-ylmethyl)acetamide IUPAC Name: 2-[(2,4-dichlorophenyl)methyl-(4-methylphenyl)sulfonylamino]-N-(pyridin-4-ylmethyl)acetamide Traditional Name: 2-[(2,4-dichlorobenzyl)-tosyl-amino]-N-(4-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=C(C=C(C=C2)Cl)Cl)CC(=O)NCC3=CC=NC=C3

Isomeric SMILES

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

InChI

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