4-[4-cyano-2-(2-naphthalen-1-ylpropanoylamino)phenyl]-N-methylsulfonyl-butanamide

Systemtic Name: 4-[4-cyano-2-(2-naphthalen-1-ylpropanoylamino)phenyl]-N-methylsulfonyl-butanamide Openeye Name: 4-[4-cyano-2-[2-(1-naphthyl)propanoylamino]phenyl]-N-methylsulfonyl-butanamide CAS Name: 4-[4-cyano-2-[[2-(1-naphthalenyl)-1-oxopropyl]amino]phenyl]-N-methylsulfonylbutanamide IUPAC Name: 4-[4-cyano-2-(2-naphthalen-1-ylpropanoylamino)phenyl]-N-methylsulfonylbutanamide Traditional Name: 4-[4-cyano-2-[2-(1-naphthyl)propanoylamino]phenyl]-N-mesyl-butyramide Formula: C25H25N3O4S MolecularWeight: 463.5487

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC2=CC=CC=C21)C(=O)NC3=C(C=CC(=C3)C#N)CCCC(=O)NS(=O)(=O)C

Isomeric SMILES

CC(C1=CC=CC2=CC=CC=C21)C(=O)NC3=C(C=CC(=C3)C#N)CCCC(=O)NS(=O)(=O)C

InChI

InChI=1S/C25H25N3O4S/c1-17(21-11-5-8-19-7-3-4-10-22(19)21)25(30)27-23-15-18(16-26)13-14-20(23)9-6-12-24(29)28-33(2,31)32/h3-5,7-8,10-11,13-15,17H,6,9,12H2,1-2H3,(H,27,30)(H,28,29)