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

Systemtic Name: (E)-3-(4-acetamidophenyl)-N-[[4-(3-oxidanylidenepiperazin-1-yl)phenyl]methyl]prop-2-enamide Openeye Name: (E)-3-(4-acetamidophenyl)-N-[[4-(3-oxopiperazin-1-yl)phenyl]methyl]prop-2-enamide CAS Name: (E)-3-(4-acetamidophenyl)-N-[[4-(3-oxo-1-piperazinyl)phenyl]methyl]-2-propenamide IUPAC Name: (E)-3-(4-acetamidophenyl)-N-[[4-(3-oxopiperazin-1-yl)phenyl]methyl]prop-2-enamide Traditional Name: (E)-3-(4-acetamidophenyl)-N-[4-(3-ketopiperazino)benzyl]acrylamide Formula: C22H24N4O3 MolecularWeight: 392.45096

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)C=CC(=O)NCC2=CC=C(C=C2)N3CCNC(=O)C3

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)/C=C/C(=O)NCC2=CC=C(C=C2)N3CCNC(=O)C3

InChI

InChI=1S/C22H24N4O3/c1-16(27)25-19-7-2-17(3-8-19)6-11-21(28)24-14-18-4-9-20(10-5-18)26-13-12-23-22(29)15-26/h2-11H,12-15H2,1H3,(H,23,29)(H,24,28)(H,25,27)/b11-6+