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

Systemtic Name: N-(cyanomethyl)-2-[3-[4-[(cyclopropylamino)methyl]phenyl]phenyl]-4-methyl-pentanamide Openeye Name: N-(cyanomethyl)-2-[3-[4-[(cyclopropylamino)methyl]phenyl]phenyl]-4-methyl-pentanamide CAS Name: N-(cyanomethyl)-2-[3-[4-[(cyclopropylamino)methyl]phenyl]phenyl]-4-methylpentanamide IUPAC Name: N-(cyanomethyl)-2-[3-[4-[(cyclopropylamino)methyl]phenyl]phenyl]-4-methylpentanamide Traditional Name: N-(cyanomethyl)-2-[3-[4-[(cyclopropylamino)methyl]phenyl]phenyl]-4-methyl-valeramide Formula: C24H29N3O MolecularWeight: 375.50656

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C1=CC=CC(=C1)C2=CC=C(C=C2)CNC3CC3)C(=O)NCC#N

Isomeric SMILES

CC(C)CC(C1=CC=CC(=C1)C2=CC=C(C=C2)CNC3CC3)C(=O)NCC#N

InChI

InChI=1S/C24H29N3O/c1-17(2)14-23(24(28)26-13-12-25)21-5-3-4-20(15-21)19-8-6-18(7-9-19)16-27-22-10-11-22/h3-9,15,17,22-23,27H,10-11,13-14,16H2,1-2H3,(H,26,28)