N-(2,5-dimethylphenyl)-2-[4-[2-oxidanylidene-2-(prop-2-enylamino)ethyl]piperazin-1-yl]-2-phenyl-ethanamide

Systemtic Name: N-(2,5-dimethylphenyl)-2-[4-[2-oxidanylidene-2-(prop-2-enylamino)ethyl]piperazin-1-yl]-2-phenyl-ethanamide Openeye Name: 2-[4-[2-(allylamino)-2-oxo-ethyl]piperazin-1-yl]-N-(2,5-dimethylphenyl)-2-phenyl-acetamide CAS Name: N-(2,5-dimethylphenyl)-2-[4-[2-oxo-2-(prop-2-enylamino)ethyl]-1-piperazinyl]-2-phenylacetamide IUPAC Name: N-(2,5-dimethylphenyl)-2-[4-[2-oxo-2-(prop-2-enylamino)ethyl]piperazin-1-yl]-2-phenylacetamide Traditional Name: 2-[4-[2-(allylamino)-2-keto-ethyl]piperazino]-N-(2,5-dimethylphenyl)-2-phenyl-acetamide Formula: C25H32N4O2 MolecularWeight: 420.54718

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NC(=O)C(C2=CC=CC=C2)N3CCN(CC3)CC(=O)NCC=C

Isomeric SMILES

CC1=CC(=C(C=C1)C)NC(=O)C(C2=CC=CC=C2)N3CCN(CC3)CC(=O)NCC=C

InChI

InChI=1S/C25H32N4O2/c1-4-12-26-23(30)18-28-13-15-29(16-14-28)24(21-8-6-5-7-9-21)25(31)27-22-17-19(2)10-11-20(22)3/h4-11,17,24H,1,12-16,18H2,2-3H3,(H,26,30)(H,27,31)