N-[[3-[3-(piperazin-1-ylmethyl)phenyl]phenyl]methyl]-2,1,3-benzoxadiazole-5-carboxamide

Systemtic Name: N-[[3-[3-(piperazin-1-ylmethyl)phenyl]phenyl]methyl]-2,1,3-benzoxadiazole-5-carboxamide Openeye Name: N-[[3-[3-(piperazin-1-ylmethyl)phenyl]phenyl]methyl]-2,1,3-benzoxadiazole-5-carboxamide CAS Name: N-[[3-[3-(1-piperazinylmethyl)phenyl]phenyl]methyl]-2,1,3-benzoxadiazole-5-carboxamide IUPAC Name: N-[[3-[3-(piperazin-1-ylmethyl)phenyl]phenyl]methyl]-2,1,3-benzoxadiazole-5-carboxamide Traditional Name: N-[3-[3-(piperazinomethyl)phenyl]benzyl]benzofurazan-5-carboxamide Formula: C25H25N5O2 MolecularWeight: 427.4983

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)CC2=CC=CC(=C2)C3=CC(=CC=C3)CNC(=O)C4=CC5=NON=C5C=C4

Isomeric SMILES

C1CN(CCN1)CC2=CC=CC(=C2)C3=CC(=CC=C3)CNC(=O)C4=CC5=NON=C5C=C4

InChI

InChI=1S/C25H25N5O2/c31-25(22-7-8-23-24(15-22)29-32-28-23)27-16-18-3-1-5-20(13-18)21-6-2-4-19(14-21)17-30-11-9-26-10-12-30/h1-8,13-15,26H,9-12,16-17H2,(H,27,31)