3-(2,4-dimethylphenyl)-N-[[4-(3-oxidanylidenepiperazin-1-yl)phenyl]methyl]propanamide

Systemtic Name: 3-(2,4-dimethylphenyl)-N-[[4-(3-oxidanylidenepiperazin-1-yl)phenyl]methyl]propanamide Openeye Name: 3-(2,4-dimethylphenyl)-N-[[4-(3-oxopiperazin-1-yl)phenyl]methyl]propanamide CAS Name: 3-(2,4-dimethylphenyl)-N-[[4-(3-oxo-1-piperazinyl)phenyl]methyl]propanamide IUPAC Name: 3-(2,4-dimethylphenyl)-N-[[4-(3-oxopiperazin-1-yl)phenyl]methyl]propanamide Traditional Name: 3-(2,4-dimethylphenyl)-N-[4-(3-ketopiperazino)benzyl]propionamide Formula: C22H27N3O2 MolecularWeight: 365.46868

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)CCC(=O)NCC2=CC=C(C=C2)N3CCNC(=O)C3)C

Isomeric SMILES

CC1=CC(=C(C=C1)CCC(=O)NCC2=CC=C(C=C2)N3CCNC(=O)C3)C

InChI

InChI=1S/C22H27N3O2/c1-16-3-6-19(17(2)13-16)7-10-21(26)24-14-18-4-8-20(9-5-18)25-12-11-23-22(27)15-25/h3-6,8-9,13H,7,10-12,14-15H2,1-2H3,(H,23,27)(H,24,26)