4-[2-[(4-bromanyl-3-methyl-phenyl)amino]-1-methyl-benzimidazol-5-yl]oxy-N-(3-imidazol-1-ylpropyl)pyridine-2-carboxamide

Systemtic Name: 4-[2-[(4-bromanyl-3-methyl-phenyl)amino]-1-methyl-benzimidazol-5-yl]oxy-N-(3-imidazol-1-ylpropyl)pyridine-2-carboxamide Openeye Name: 4-[2-(4-bromo-3-methyl-anilino)-1-methyl-benzimidazol-5-yl]oxy-N-(3-imidazol-1-ylpropyl)pyridine-2-carboxamide CAS Name: 4-[[2-(4-bromo-3-methylanilino)-1-methyl-5-benzimidazolyl]oxy]-N-[3-(1-imidazolyl)propyl]-2-pyridinecarboxamide IUPAC Name: 4-[2-(4-bromo-3-methylanilino)-1-methylbenzimidazol-5-yl]oxy-N-(3-imidazol-1-ylpropyl)pyridine-2-carboxamide Traditional Name: 4-[2-(4-bromo-3-methyl-anilino)-1-methyl-benzimidazol-5-yl]oxy-N-(3-imidazol-1-ylpropyl)picolinamide Formula: C27H26BrN7O2 MolecularWeight: 560.44504

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC2=NC3=C(N2C)C=CC(=C3)OC4=CC(=NC=C4)C(=O)NCCCN5C=CN=C5)Br

Isomeric SMILES

CC1=C(C=CC(=C1)NC2=NC3=C(N2C)C=CC(=C3)OC4=CC(=NC=C4)C(=O)NCCCN5C=CN=C5)Br

InChI

InChI=1S/C27H26BrN7O2/c1-18-14-19(4-6-22(18)28)32-27-33-23-15-20(5-7-25(23)34(27)2)37-21-8-10-30-24(16-21)26(36)31-9-3-12-35-13-11-29-17-35/h4-8,10-11,13-17H,3,9,12H2,1-2H3,(H,31,36)(H,32,33)