3-[[4-(1H-benzimidazol-2-yl)phenyl]amino]-2-[(2-chlorophenyl)methyl]-3H-isoindol-1-one

Systemtic Name: 3-[[4-(1H-benzimidazol-2-yl)phenyl]amino]-2-[(2-chlorophenyl)methyl]-3H-isoindol-1-one Openeye Name: 3-[4-(1H-benzimidazol-2-yl)anilino]-2-[(2-chlorophenyl)methyl]isoindolin-1-one CAS Name: 3-[4-(1H-benzimidazol-2-yl)anilino]-2-[(2-chlorophenyl)methyl]-3H-isoindol-1-one IUPAC Name: 3-[4-(1H-benzimidazol-2-yl)anilino]-2-[(2-chlorophenyl)methyl]-3H-isoindol-1-one Traditional Name: 3-[4-(1H-benzimidazol-2-yl)anilino]-2-(2-chlorobenzyl)isoindolin-1-one Formula: C28H21ClN4O MolecularWeight: 464.94554

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CN2C(C3=CC=CC=C3C2=O)NC4=CC=C(C=C4)C5=NC6=CC=CC=C6N5)Cl

Isomeric SMILES

C1=CC=C(C(=C1)CN2C(C3=CC=CC=C3C2=O)NC4=CC=C(C=C4)C5=NC6=CC=CC=C6N5)Cl

InChI

InChI=1S/C28H21ClN4O/c29-23-10-4-1-7-19(23)17-33-27(21-8-2-3-9-22(21)28(33)34)30-20-15-13-18(14-16-20)26-31-24-11-5-6-12-25(24)32-26/h1-16,27,30H,17H2,(H,31,32)