2-iodanyl-N-[2-[4-(phenylmethyl)piperazin-1-yl]-2-pyridin-3-yl-ethyl]benzamide

Systemtic Name: 2-iodanyl-N-[2-[4-(phenylmethyl)piperazin-1-yl]-2-pyridin-3-yl-ethyl]benzamide Openeye Name: N-[2-(4-benzylpiperazin-1-yl)-2-(3-pyridyl)ethyl]-2-iodo-benzamide CAS Name: 2-iodo-N-[2-[4-(phenylmethyl)-1-piperazinyl]-2-(3-pyridinyl)ethyl]benzamide IUPAC Name: N-[2-(4-benzylpiperazin-1-yl)-2-pyridin-3-ylethyl]-2-iodobenzamide Traditional Name: N-[2-(4-benzylpiperazino)-2-(3-pyridyl)ethyl]-2-iodo-benzamide Formula: C25H27IN4O MolecularWeight: 526.41255

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)C(CNC(=O)C3=CC=CC=C3I)C4=CN=CC=C4

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)C(CNC(=O)C3=CC=CC=C3I)C4=CN=CC=C4

InChI

InChI=1S/C25H27IN4O/c26-23-11-5-4-10-22(23)25(31)28-18-24(21-9-6-12-27-17-21)30-15-13-29(14-16-30)19-20-7-2-1-3-8-20/h1-12,17,24H,13-16,18-19H2,(H,28,31)