2-[3-[3-(2-azanylethyl)-1H-indol-5-yl]phenyl]-N-(cyanomethyl)-4-methyl-pentanamide

Systemtic Name: 2-[3-[3-(2-azanylethyl)-1H-indol-5-yl]phenyl]-N-(cyanomethyl)-4-methyl-pentanamide Openeye Name: 2-[3-[3-(2-aminoethyl)-1H-indol-5-yl]phenyl]-N-(cyanomethyl)-4-methyl-pentanamide CAS Name: 2-[3-[3-(2-aminoethyl)-1H-indol-5-yl]phenyl]-N-(cyanomethyl)-4-methylpentanamide IUPAC Name: 2-[3-[3-(2-aminoethyl)-1H-indol-5-yl]phenyl]-N-(cyanomethyl)-4-methylpentanamide Traditional Name: 2-[3-[3-(2-aminoethyl)-1H-indol-5-yl]phenyl]-N-(cyanomethyl)-4-methyl-valeramide Formula: C24H28N4O MolecularWeight: 388.50532

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C1=CC=CC(=C1)C2=CC3=C(C=C2)NC=C3CCN)C(=O)NCC#N

Isomeric SMILES

CC(C)CC(C1=CC=CC(=C1)C2=CC3=C(C=C2)NC=C3CCN)C(=O)NCC#N

InChI

InChI=1S/C24H28N4O/c1-16(2)12-22(24(29)27-11-10-26)19-5-3-4-17(13-19)18-6-7-23-21(14-18)20(8-9-25)15-28-23/h3-7,13-16,22,28H,8-9,11-12,25H2,1-2H3,(H,27,29)