2-iodanyl-N-[5-(4-methylphenyl)benzimidazolo[2,1-a]phthalazin-9-yl]benzamide

Systemtic Name: 2-iodanyl-N-[5-(4-methylphenyl)benzimidazolo[2,1-a]phthalazin-9-yl]benzamide Openeye Name: 2-iodo-N-[5-(p-tolyl)benzimidazolo[2,1-a]phthalazin-9-yl]benzamide CAS Name: 2-iodo-N-[5-(4-methylphenyl)-9-benzimidazolo[2,1-a]phthalazinyl]benzamide IUPAC Name: 2-iodo-N-[5-(4-methylphenyl)benzimidazolo[2,1-a]phthalazin-9-yl]benzamide Traditional Name: 2-iodo-N-[5-(p-tolyl)benzimidazolo[2,1-a]phthalazin-9-yl]benzamide Formula: C28H19IN4O MolecularWeight: 554.38113

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN3C4=C(C=CC(=C4)NC(=O)C5=CC=CC=C5I)N=C3C6=CC=CC=C62

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN3C4=C(C=CC(=C4)NC(=O)C5=CC=CC=C5I)N=C3C6=CC=CC=C62

InChI

InChI=1S/C28H19IN4O/c1-17-10-12-18(13-11-17)26-20-6-2-3-7-21(20)27-31-24-15-14-19(16-25(24)33(27)32-26)30-28(34)22-8-4-5-9-23(22)29/h2-16H,1H3,(H,30,34)