3-[[2-chloranyl-4-(2-phenylethynyl)phenyl]methyl]-N-(4-ethenylphenyl)sulfonyl-2-methyl-benzimidazole-5-carboxamide

Systemtic Name: 3-[[2-chloranyl-4-(2-phenylethynyl)phenyl]methyl]-N-(4-ethenylphenyl)sulfonyl-2-methyl-benzimidazole-5-carboxamide Openeye Name: 3-[[2-chloro-4-(2-phenylethynyl)phenyl]methyl]-2-methyl-N-(4-vinylphenyl)sulfonyl-benzimidazole-5-carboxamide CAS Name: 3-[[2-chloro-4-(2-phenylethynyl)phenyl]methyl]-N-(4-ethenylphenyl)sulfonyl-2-methyl-5-benzimidazolecarboxamide IUPAC Name: 3-[[2-chloro-4-(2-phenylethynyl)phenyl]methyl]-N-(4-ethenylphenyl)sulfonyl-2-methylbenzimidazole-5-carboxamide Traditional Name: 3-[2-chloro-4-(2-phenylethynyl)benzyl]-2-methyl-N-(4-vinylphenyl)sulfonyl-benzimidazole-5-carboxamide Formula: C32H24ClN3O3S MolecularWeight: 566.06926

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(N1CC3=C(C=C(C=C3)C#CC4=CC=CC=C4)Cl)C=C(C=C2)C(=O)NS(=O)(=O)C5=CC=C(C=C5)C=C

Isomeric SMILES

CC1=NC2=C(N1CC3=C(C=C(C=C3)C#CC4=CC=CC=C4)Cl)C=C(C=C2)C(=O)NS(=O)(=O)C5=CC=C(C=C5)C=C

InChI

InChI=1S/C32H24ClN3O3S/c1-3-23-12-16-28(17-13-23)40(38,39)35-32(37)26-15-18-30-31(20-26)36(22(2)34-30)21-27-14-11-25(19-29(27)33)10-9-24-7-5-4-6-8-24/h3-8,11-20H,1,21H2,2H3,(H,35,37)