N-(8-methylquinolin-5-yl)-2-[2-(methylsulfonylmethyl)benzimidazol-1-yl]ethanamide

Systemtic Name: N-(8-methylquinolin-5-yl)-2-[2-(methylsulfonylmethyl)benzimidazol-1-yl]ethanamide Openeye Name: N-(8-methyl-5-quinolyl)-2-[2-(methylsulfonylmethyl)benzimidazol-1-yl]acetamide CAS Name: N-(8-methyl-5-quinolinyl)-2-[2-(methylsulfonylmethyl)-1-benzimidazolyl]acetamide IUPAC Name: N-(8-methylquinolin-5-yl)-2-[2-(methylsulfonylmethyl)benzimidazol-1-yl]acetamide Traditional Name: 2-[2-(mesylmethyl)benzimidazol-1-yl]-N-(8-methyl-5-quinolyl)acetamide Formula: C21H20N4O3S MolecularWeight: 408.4735

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C=C1)NC(=O)CN3C4=CC=CC=C4N=C3CS(=O)(=O)C)C=CC=N2

Isomeric SMILES

CC1=C2C(=C(C=C1)NC(=O)CN3C4=CC=CC=C4N=C3CS(=O)(=O)C)C=CC=N2

InChI

InChI=1S/C21H20N4O3S/c1-14-9-10-16(15-6-5-11-22-21(14)15)24-20(26)12-25-18-8-4-3-7-17(18)23-19(25)13-29(2,27)28/h3-11H,12-13H2,1-2H3,(H,24,26)