(E)-2-cyano-N-[[4-(3-oxidanylidenepiperazin-1-yl)phenyl]methyl]-3-(4-propan-2-ylphenyl)prop-2-enamide

Systemtic Name: (E)-2-cyano-N-[[4-(3-oxidanylidenepiperazin-1-yl)phenyl]methyl]-3-(4-propan-2-ylphenyl)prop-2-enamide Openeye Name: (E)-2-cyano-3-(4-isopropylphenyl)-N-[[4-(3-oxopiperazin-1-yl)phenyl]methyl]prop-2-enamide CAS Name: (E)-2-cyano-N-[[4-(3-oxo-1-piperazinyl)phenyl]methyl]-3-(4-propan-2-ylphenyl)-2-propenamide IUPAC Name: (E)-2-cyano-N-[[4-(3-oxopiperazin-1-yl)phenyl]methyl]-3-(4-propan-2-ylphenyl)prop-2-enamide Traditional Name: (E)-2-cyano-N-[4-(3-ketopiperazino)benzyl]-3-p-cumenyl-acrylamide Formula: C24H26N4O2 MolecularWeight: 402.48884

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C=C(C#N)C(=O)NCC2=CC=C(C=C2)N3CCNC(=O)C3

Isomeric SMILES

CC(C)C1=CC=C(C=C1)/C=C(\C#N)/C(=O)NCC2=CC=C(C=C2)N3CCNC(=O)C3

InChI

InChI=1S/C24H26N4O2/c1-17(2)20-7-3-18(4-8-20)13-21(14-25)24(30)27-15-19-5-9-22(10-6-19)28-12-11-26-23(29)16-28/h3-10,13,17H,11-12,15-16H2,1-2H3,(H,26,29)(H,27,30)/b21-13+