2-[[4-chloranyl-6-(3-oxidanylidene-1H-isoindol-2-yl)-2-propyl-benzimidazol-1-yl]methyl]-6-phenyl-benzenecarbonitrile

Systemtic Name: 2-[[4-chloranyl-6-(3-oxidanylidene-1H-isoindol-2-yl)-2-propyl-benzimidazol-1-yl]methyl]-6-phenyl-benzenecarbonitrile Openeye Name: 2-[[4-chloro-6-(1-oxoisoindolin-2-yl)-2-propyl-benzimidazol-1-yl]methyl]-6-phenyl-benzonitrile CAS Name: 2-[[4-chloro-6-(3-oxo-1H-isoindol-2-yl)-2-propyl-1-benzimidazolyl]methyl]-6-phenylbenzonitrile IUPAC Name: 2-[[4-chloro-6-(3-oxo-1H-isoindol-2-yl)-2-propylbenzimidazol-1-yl]methyl]-6-phenylbenzonitrile Traditional Name: 2-[[4-chloro-6-(1-ketoisoindolin-2-yl)-2-propyl-benzimidazol-1-yl]methyl]-6-phenyl-benzonitrile Formula: C32H25ClN4O MolecularWeight: 517.0201

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC2=C(C=C(C=C2N1CC3=CC=CC(=C3C#N)C4=CC=CC=C4)N5CC6=CC=CC=C6C5=O)Cl

Isomeric SMILES

CCCC1=NC2=C(C=C(C=C2N1CC3=CC=CC(=C3C#N)C4=CC=CC=C4)N5CC6=CC=CC=C6C5=O)Cl

InChI

InChI=1S/C32H25ClN4O/c1-2-9-30-35-31-28(33)16-24(36-19-22-12-6-7-14-26(22)32(36)38)17-29(31)37(30)20-23-13-8-15-25(27(23)18-34)21-10-4-3-5-11-21/h3-8,10-17H,2,9,19-20H2,1H3