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

Systemtic Name: 2-[3-[3-(2-azanylethyl)-1H-indol-4-yl]phenyl]-N-(cyanomethyl)-4-methyl-pentanamide Openeye Name: 2-[3-[3-(2-aminoethyl)-1H-indol-4-yl]phenyl]-N-(cyanomethyl)-4-methyl-pentanamide CAS Name: 2-[3-[3-(2-aminoethyl)-1H-indol-4-yl]phenyl]-N-(cyanomethyl)-4-methylpentanamide IUPAC Name: 2-[3-[3-(2-aminoethyl)-1H-indol-4-yl]phenyl]-N-(cyanomethyl)-4-methylpentanamide Traditional Name: 2-[3-[3-(2-aminoethyl)-1H-indol-4-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=C3C(=CC=C2)NC=C3CCN)C(=O)NCC#N

Isomeric SMILES

CC(C)CC(C1=CC=CC(=C1)C2=C3C(=CC=C2)NC=C3CCN)C(=O)NCC#N

InChI

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