4-bromanyl-7-methoxy-1-(2-methoxyethyl)-5-[(2-methylsulfanylpyridin-3-yl)methyl]-2-(4-propan-2-ylphenyl)benzimidazole

Systemtic Name: 4-bromanyl-7-methoxy-1-(2-methoxyethyl)-5-[(2-methylsulfanylpyridin-3-yl)methyl]-2-(4-propan-2-ylphenyl)benzimidazole Openeye Name: 4-bromo-2-(4-isopropylphenyl)-7-methoxy-1-(2-methoxyethyl)-5-[(2-methylsulfanyl-3-pyridyl)methyl]benzimidazole CAS Name: 4-bromo-7-methoxy-1-(2-methoxyethyl)-5-[[2-(methylthio)-3-pyridinyl]methyl]-2-(4-propan-2-ylphenyl)benzimidazole IUPAC Name: 4-bromo-7-methoxy-1-(2-methoxyethyl)-5-[(2-methylsulfanylpyridin-3-yl)methyl]-2-(4-propan-2-ylphenyl)benzimidazole Traditional Name: 4-bromo-7-methoxy-1-(2-methoxyethyl)-5-[[2-(methylthio)-3-pyridyl]methyl]-2-p-cumenyl-benzimidazole Formula: C27H30BrN3O2S MolecularWeight: 540.515

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C2=NC3=C(C(=CC(=C3N2CCOC)OC)CC4=C(N=CC=C4)SC)Br

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C2=NC3=C(C(=CC(=C3N2CCOC)OC)CC4=C(N=CC=C4)SC)Br

InChI

InChI=1S/C27H30BrN3O2S/c1-17(2)18-8-10-19(11-9-18)26-30-24-23(28)21(15-20-7-6-12-29-27(20)34-5)16-22(33-4)25(24)31(26)13-14-32-3/h6-12,16-17H,13-15H2,1-5H3