N-[[1-[3-(4-chloranyl-3,5-dimethyl-phenoxy)propyl]benzimidazol-2-yl]methyl]-4-methyl-benzamide

Systemtic Name: N-[[1-[3-(4-chloranyl-3,5-dimethyl-phenoxy)propyl]benzimidazol-2-yl]methyl]-4-methyl-benzamide Openeye Name: N-[[1-[3-(4-chloro-3,5-dimethyl-phenoxy)propyl]benzimidazol-2-yl]methyl]-4-methyl-benzamide CAS Name: N-[[1-[3-(4-chloro-3,5-dimethylphenoxy)propyl]-2-benzimidazolyl]methyl]-4-methylbenzamide IUPAC Name: N-[[1-[3-(4-chloro-3,5-dimethylphenoxy)propyl]benzimidazol-2-yl]methyl]-4-methylbenzamide Traditional Name: N-[[1-[3-(4-chloro-3,5-dimethyl-phenoxy)propyl]benzimidazol-2-yl]methyl]-4-methyl-benzamide Formula: C27H28ClN3O2 MolecularWeight: 461.98312

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NCC2=NC3=CC=CC=C3N2CCCOC4=CC(=C(C(=C4)C)Cl)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)NCC2=NC3=CC=CC=C3N2CCCOC4=CC(=C(C(=C4)C)Cl)C

InChI

InChI=1S/C27H28ClN3O2/c1-18-9-11-21(12-10-18)27(32)29-17-25-30-23-7-4-5-8-24(23)31(25)13-6-14-33-22-15-19(2)26(28)20(3)16-22/h4-5,7-12,15-16H,6,13-14,17H2,1-3H3,(H,29,32)