N-[[4-(3-oxidanylidenepiperazin-1-yl)phenyl]methyl]-2-[(phenylmethyl)carbamoylamino]ethanamide

Systemtic Name: N-[[4-(3-oxidanylidenepiperazin-1-yl)phenyl]methyl]-2-[(phenylmethyl)carbamoylamino]ethanamide Openeye Name: 2-(benzylcarbamoylamino)-N-[[4-(3-oxopiperazin-1-yl)phenyl]methyl]acetamide CAS Name: 2-[[oxo-[(phenylmethyl)amino]methyl]amino]-N-[[4-(3-oxo-1-piperazinyl)phenyl]methyl]acetamide IUPAC Name: 2-(benzylcarbamoylamino)-N-[[4-(3-oxopiperazin-1-yl)phenyl]methyl]acetamide Traditional Name: 2-(benzylcarbamoylamino)-N-[4-(3-ketopiperazino)benzyl]acetamide Formula: C21H25N5O3 MolecularWeight: 395.4549

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(=O)N1)C2=CC=C(C=C2)CNC(=O)CNC(=O)NCC3=CC=CC=C3

Isomeric SMILES

C1CN(CC(=O)N1)C2=CC=C(C=C2)CNC(=O)CNC(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C21H25N5O3/c27-19(14-25-21(29)24-13-16-4-2-1-3-5-16)23-12-17-6-8-18(9-7-17)26-11-10-22-20(28)15-26/h1-9H,10-15H2,(H,22,28)(H,23,27)(H2,24,25,29)