3-(4-tert-butylphenyl)-N-[[4-(3-oxidanylidenepiperazin-1-yl)phenyl]methyl]propanamide

Systemtic Name: 3-(4-tert-butylphenyl)-N-[[4-(3-oxidanylidenepiperazin-1-yl)phenyl]methyl]propanamide Openeye Name: 3-(4-tert-butylphenyl)-N-[[4-(3-oxopiperazin-1-yl)phenyl]methyl]propanamide CAS Name: 3-(4-tert-butylphenyl)-N-[[4-(3-oxo-1-piperazinyl)phenyl]methyl]propanamide IUPAC Name: 3-(4-tert-butylphenyl)-N-[[4-(3-oxopiperazin-1-yl)phenyl]methyl]propanamide Traditional Name: 3-(4-tert-butylphenyl)-N-[4-(3-ketopiperazino)benzyl]propionamide Formula: C24H31N3O2 MolecularWeight: 393.52184

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H31N3O2/c1-24(2,3)20-9-4-18(5-10-20)8-13-22(28)26-16-19-6-11-21(12-7-19)27-15-14-25-23(29)17-27/h4-7,9-12H,8,13-17H2,1-3H3,(H,25,29)(H,26,28)