1-[5-[6-(4-methylsulfonylphenoxy)-2-pyridin-2-yl-3H-benzimidazol-5-yl]-2,3-dihydropyrrol-1-yl]ethanone

Systemtic Name: 1-[5-[6-(4-methylsulfonylphenoxy)-2-pyridin-2-yl-3H-benzimidazol-5-yl]-2,3-dihydropyrrol-1-yl]ethanone Openeye Name: 1-[5-[6-(4-methylsulfonylphenoxy)-2-(2-pyridyl)-3H-benzimidazol-5-yl]-2,3-dihydropyrrol-1-yl]ethanone CAS Name: 1-[5-[6-(4-methylsulfonylphenoxy)-2-(2-pyridinyl)-3H-benzimidazol-5-yl]-2,3-dihydropyrrol-1-yl]ethanone IUPAC Name: 1-[5-[6-(4-methylsulfonylphenoxy)-2-pyridin-2-yl-3H-benzimidazol-5-yl]-2,3-dihydropyrrol-1-yl]ethanone Traditional Name: 1-[2-[6-(4-mesylphenoxy)-2-(2-pyridyl)-3H-benzimidazol-5-yl]-2-pyrrolin-1-yl]ethanone Formula: C25H22N4O4S MolecularWeight: 474.53158

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCC=C1C2=CC3=C(C=C2OC4=CC=C(C=C4)S(=O)(=O)C)N=C(N3)C5=CC=CC=N5

Isomeric SMILES

CC(=O)N1CCC=C1C2=CC3=C(C=C2OC4=CC=C(C=C4)S(=O)(=O)C)N=C(N3)C5=CC=CC=N5

InChI

InChI=1S/C25H22N4O4S/c1-16(30)29-13-5-7-23(29)19-14-21-22(28-25(27-21)20-6-3-4-12-26-20)15-24(19)33-17-8-10-18(11-9-17)34(2,31)32/h3-4,6-12,14-15H,5,13H2,1-2H3,(H,27,28)