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

Systemtic Name: 4-[2-[(4-bromanyl-3-methyl-phenyl)amino]-1-methyl-benzimidazol-5-yl]oxy-N-(2-morpholin-4-ylethyl)pyridine-2-carboxamide Openeye Name: 4-[2-(4-bromo-3-methyl-anilino)-1-methyl-benzimidazol-5-yl]oxy-N-(2-morpholinoethyl)pyridine-2-carboxamide CAS Name: 4-[[2-(4-bromo-3-methylanilino)-1-methyl-5-benzimidazolyl]oxy]-N-[2-(4-morpholinyl)ethyl]-2-pyridinecarboxamide IUPAC Name: 4-[2-(4-bromo-3-methylanilino)-1-methylbenzimidazol-5-yl]oxy-N-(2-morpholin-4-ylethyl)pyridine-2-carboxamide Traditional Name: 4-[2-(4-bromo-3-methyl-anilino)-1-methyl-benzimidazol-5-yl]oxy-N-(2-morpholinoethyl)picolinamide Formula: C27H29BrN6O3 MolecularWeight: 565.46156

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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)NCCN5CCOCC5)Br

Isomeric SMILES

CC1=C(C=CC(=C1)NC2=NC3=C(N2C)C=CC(=C3)OC4=CC(=NC=C4)C(=O)NCCN5CCOCC5)Br

InChI

InChI=1S/C27H29BrN6O3/c1-18-15-19(3-5-22(18)28)31-27-32-23-16-20(4-6-25(23)33(27)2)37-21-7-8-29-24(17-21)26(35)30-9-10-34-11-13-36-14-12-34/h3-8,15-17H,9-14H2,1-2H3,(H,30,35)(H,31,32)