5-chloranyl-2-iodanyl-N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]benzamide

Systemtic Name: 5-chloranyl-2-iodanyl-N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]benzamide Openeye Name: 5-chloro-2-iodo-N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]benzamide CAS Name: 5-chloro-2-iodo-N-[3-[4-(2-pyrimidinyl)-1-piperazinyl]propyl]benzamide IUPAC Name: 5-chloro-2-iodo-N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]benzamide Traditional Name: 5-chloro-2-iodo-N-[3-[4-(2-pyrimidyl)piperazino]propyl]benzamide Formula: C18H21ClIN5O MolecularWeight: 485.74971

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCNC(=O)C2=C(C=CC(=C2)Cl)I)C3=NC=CC=N3

Isomeric SMILES

C1CN(CCN1CCCNC(=O)C2=C(C=CC(=C2)Cl)I)C3=NC=CC=N3

InChI

InChI=1S/C18H21ClIN5O/c19-14-3-4-16(20)15(13-14)17(26)21-7-2-8-24-9-11-25(12-10-24)18-22-5-1-6-23-18/h1,3-6,13H,2,7-12H2,(H,21,26)