4-[2-[(4-bromanyl-3-methyl-phenyl)amino]-6-methoxy-1-methyl-benzimidazol-5-yl]oxy-N-(3-imidazol-1-ylpropyl)pyridine-2-carboxamide

Systemtic Name: 4-[2-[(4-bromanyl-3-methyl-phenyl)amino]-6-methoxy-1-methyl-benzimidazol-5-yl]oxy-N-(3-imidazol-1-ylpropyl)pyridine-2-carboxamide Openeye Name: 4-[2-(4-bromo-3-methyl-anilino)-6-methoxy-1-methyl-benzimidazol-5-yl]oxy-N-(3-imidazol-1-ylpropyl)pyridine-2-carboxamide CAS Name: 4-[[2-(4-bromo-3-methylanilino)-6-methoxy-1-methyl-5-benzimidazolyl]oxy]-N-[3-(1-imidazolyl)propyl]-2-pyridinecarboxamide IUPAC Name: 4-[2-(4-bromo-3-methylanilino)-6-methoxy-1-methylbenzimidazol-5-yl]oxy-N-(3-imidazol-1-ylpropyl)pyridine-2-carboxamide Traditional Name: 4-[2-(4-bromo-3-methyl-anilino)-6-methoxy-1-methyl-benzimidazol-5-yl]oxy-N-(3-imidazol-1-ylpropyl)picolinamide Formula: C28H28BrN7O3 MolecularWeight: 590.47102

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC2=NC3=CC(=C(C=C3N2C)OC)OC4=CC(=NC=C4)C(=O)NCCCN5C=CN=C5)Br

Isomeric SMILES

CC1=C(C=CC(=C1)NC2=NC3=CC(=C(C=C3N2C)OC)OC4=CC(=NC=C4)C(=O)NCCCN5C=CN=C5)Br

InChI

InChI=1S/C28H28BrN7O3/c1-18-13-19(5-6-21(18)29)33-28-34-22-15-26(25(38-3)16-24(22)35(28)2)39-20-7-9-31-23(14-20)27(37)32-8-4-11-36-12-10-30-17-36/h5-7,9-10,12-17H,4,8,11H2,1-3H3,(H,32,37)(H,33,34)