N-[2-[6-(azepan-1-yl)pyrimidin-4-yl]oxyethyl]-2-iodanyl-benzamide

Systemtic Name: N-[2-[6-(azepan-1-yl)pyrimidin-4-yl]oxyethyl]-2-iodanyl-benzamide Openeye Name: N-[2-[6-(azepan-1-yl)pyrimidin-4-yl]oxyethyl]-2-iodo-benzamide CAS Name: N-[2-[[6-(1-azepanyl)-4-pyrimidinyl]oxy]ethyl]-2-iodobenzamide IUPAC Name: N-[2-[6-(azepan-1-yl)pyrimidin-4-yl]oxyethyl]-2-iodobenzamide Traditional Name: N-[2-[6-(azepan-1-yl)pyrimidin-4-yl]oxyethyl]-2-iodo-benzamide Formula: C19H23IN4O2 MolecularWeight: 466.31599

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=CC(=NC=N2)OCCNC(=O)C3=CC=CC=C3I

Isomeric SMILES

C1CCCN(CC1)C2=CC(=NC=N2)OCCNC(=O)C3=CC=CC=C3I

InChI

InChI=1S/C19H23IN4O2/c20-16-8-4-3-7-15(16)19(25)21-9-12-26-18-13-17(22-14-23-18)24-10-5-1-2-6-11-24/h3-4,7-8,13-14H,1-2,5-6,9-12H2,(H,21,25)