N-[4-(cyanomethyl)phenyl]-2-[(2,4-dichlorophenyl)-methylsulfonyl-amino]ethanamide

Systemtic Name: N-[4-(cyanomethyl)phenyl]-2-[(2,4-dichlorophenyl)-methylsulfonyl-amino]ethanamide Openeye Name: N-[4-(cyanomethyl)phenyl]-2-(2,4-dichloro-N-methylsulfonyl-anilino)acetamide CAS Name: N-[4-(cyanomethyl)phenyl]-2-(2,4-dichloro-N-methylsulfonylanilino)acetamide IUPAC Name: N-[4-(cyanomethyl)phenyl]-2-(2,4-dichloro-N-methylsulfonylanilino)acetamide Traditional Name: N-[4-(cyanomethyl)phenyl]-2-(2,4-dichloro-N-mesyl-anilino)acetamide Formula: C17H15Cl2N3O3S MolecularWeight: 412.2903

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(CC(=O)NC1=CC=C(C=C1)CC#N)C2=C(C=C(C=C2)Cl)Cl

Isomeric SMILES

CS(=O)(=O)N(CC(=O)NC1=CC=C(C=C1)CC#N)C2=C(C=C(C=C2)Cl)Cl

InChI

InChI=1S/C17H15Cl2N3O3S/c1-26(24,25)22(16-7-4-13(18)10-15(16)19)11-17(23)21-14-5-2-12(3-6-14)8-9-20/h2-7,10H,8,11H2,1H3,(H,21,23)