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

Systemtic Name: N-[4-(cyanomethyl)phenyl]-2-[(4-ethoxyphenyl)-methylsulfonyl-amino]ethanamide Openeye Name: N-[4-(cyanomethyl)phenyl]-2-(4-ethoxy-N-methylsulfonyl-anilino)acetamide CAS Name: N-[4-(cyanomethyl)phenyl]-2-(4-ethoxy-N-methylsulfonylanilino)acetamide IUPAC Name: N-[4-(cyanomethyl)phenyl]-2-(4-ethoxy-N-methylsulfonylanilino)acetamide Traditional Name: N-[4-(cyanomethyl)phenyl]-2-(4-ethoxy-N-mesyl-anilino)acetamide Formula: C19H21N3O4S MolecularWeight: 387.45274

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N(CC(=O)NC2=CC=C(C=C2)CC#N)S(=O)(=O)C

Isomeric SMILES

CCOC1=CC=C(C=C1)N(CC(=O)NC2=CC=C(C=C2)CC#N)S(=O)(=O)C

InChI

InChI=1S/C19H21N3O4S/c1-3-26-18-10-8-17(9-11-18)22(27(2,24)25)14-19(23)21-16-6-4-15(5-7-16)12-13-20/h4-11H,3,12,14H2,1-2H3,(H,21,23)