N-(cyanomethyl)-2-[3-[4-(2-hydroxyethylsulfamoyl)phenyl]phenyl]-4-methyl-pentanamide

Systemtic Name: N-(cyanomethyl)-2-[3-[4-(2-hydroxyethylsulfamoyl)phenyl]phenyl]-4-methyl-pentanamide Openeye Name: N-(cyanomethyl)-2-[3-[4-(2-hydroxyethylsulfamoyl)phenyl]phenyl]-4-methyl-pentanamide CAS Name: N-(cyanomethyl)-2-[3-[4-(2-hydroxyethylsulfamoyl)phenyl]phenyl]-4-methylpentanamide IUPAC Name: N-(cyanomethyl)-2-[3-[4-(2-hydroxyethylsulfamoyl)phenyl]phenyl]-4-methylpentanamide Traditional Name: N-(cyanomethyl)-2-[3-[4-(2-hydroxyethylsulfamoyl)phenyl]phenyl]-4-methyl-valeramide Formula: C22H27N3O4S MolecularWeight: 429.53248

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H27N3O4S/c1-16(2)14-21(22(27)24-11-10-23)19-5-3-4-18(15-19)17-6-8-20(9-7-17)30(28,29)25-12-13-26/h3-9,15-16,21,25-26H,11-14H2,1-2H3,(H,24,27)