N-[[4-(3-oxidanylidenepiperazin-1-yl)phenyl]methyl]pyrazine-2-carboxamide

Systemtic Name: N-[[4-(3-oxidanylidenepiperazin-1-yl)phenyl]methyl]pyrazine-2-carboxamide Openeye Name: N-[[4-(3-oxopiperazin-1-yl)phenyl]methyl]pyrazine-2-carboxamide CAS Name: N-[[4-(3-oxo-1-piperazinyl)phenyl]methyl]-2-pyrazinecarboxamide IUPAC Name: N-[[4-(3-oxopiperazin-1-yl)phenyl]methyl]pyrazine-2-carboxamide Traditional Name: N-[4-(3-ketopiperazino)benzyl]pyrazinamide Formula: C16H17N5O2 MolecularWeight: 311.33848

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(=O)N1)C2=CC=C(C=C2)CNC(=O)C3=NC=CN=C3

Isomeric SMILES

C1CN(CC(=O)N1)C2=CC=C(C=C2)CNC(=O)C3=NC=CN=C3

InChI

InChI=1S/C16H17N5O2/c22-15-11-21(8-7-19-15)13-3-1-12(2-4-13)9-20-16(23)14-10-17-5-6-18-14/h1-6,10H,7-9,11H2,(H,19,22)(H,20,23)