N-[4-(cyanomethyl)phenyl]-2-[(2,4-dimethyl-3-methylsulfonyl-phenyl)amino]ethanamide

Systemtic Name: N-[4-(cyanomethyl)phenyl]-2-[(2,4-dimethyl-3-methylsulfonyl-phenyl)amino]ethanamide Openeye Name: N-[4-(cyanomethyl)phenyl]-2-(2,4-dimethyl-3-methylsulfonyl-anilino)acetamide CAS Name: N-[4-(cyanomethyl)phenyl]-2-(2,4-dimethyl-3-methylsulfonylanilino)acetamide IUPAC Name: N-[4-(cyanomethyl)phenyl]-2-(2,4-dimethyl-3-methylsulfonylanilino)acetamide Traditional Name: N-[4-(cyanomethyl)phenyl]-2-(3-mesyl-2,4-dimethyl-anilino)acetamide Formula: C19H21N3O3S MolecularWeight: 371.45334

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)NCC(=O)NC2=CC=C(C=C2)CC#N)C)S(=O)(=O)C

Isomeric SMILES

CC1=C(C(=C(C=C1)NCC(=O)NC2=CC=C(C=C2)CC#N)C)S(=O)(=O)C

InChI

InChI=1S/C19H21N3O3S/c1-13-4-9-17(14(2)19(13)26(3,24)25)21-12-18(23)22-16-7-5-15(6-8-16)10-11-20/h4-9,21H,10,12H2,1-3H3,(H,22,23)