N-[4-(cyanomethyl)phenyl]-2-[(4-fluorophenyl)-methylsulfonyl-amino]butanamide

Systemtic Name: N-[4-(cyanomethyl)phenyl]-2-[(4-fluorophenyl)-methylsulfonyl-amino]butanamide Openeye Name: N-[4-(cyanomethyl)phenyl]-2-(4-fluoro-N-methylsulfonyl-anilino)butanamide CAS Name: N-[4-(cyanomethyl)phenyl]-2-(4-fluoro-N-methylsulfonylanilino)butanamide IUPAC Name: N-[4-(cyanomethyl)phenyl]-2-(4-fluoro-N-methylsulfonylanilino)butanamide Traditional Name: N-[4-(cyanomethyl)phenyl]-2-(4-fluoro-N-mesyl-anilino)butyramide Formula: C19H20FN3O3S MolecularWeight: 389.443803

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=C(C=C1)CC#N)N(C2=CC=C(C=C2)F)S(=O)(=O)C

Isomeric SMILES

CCC(C(=O)NC1=CC=C(C=C1)CC#N)N(C2=CC=C(C=C2)F)S(=O)(=O)C

InChI

InChI=1S/C19H20FN3O3S/c1-3-18(19(24)22-16-8-4-14(5-9-16)12-13-21)23(27(2,25)26)17-10-6-15(20)7-11-17/h4-11,18H,3,12H2,1-2H3,(H,22,24)