3-[1-butyl-5-(dimethylsulfamoyl)benzimidazol-2-yl]-N-(pyridin-3-ylmethyl)propanamide

Systemtic Name: 3-[1-butyl-5-(dimethylsulfamoyl)benzimidazol-2-yl]-N-(pyridin-3-ylmethyl)propanamide Openeye Name: 3-[1-butyl-5-(dimethylsulfamoyl)benzimidazol-2-yl]-N-(3-pyridylmethyl)propanamide CAS Name: 3-[1-butyl-5-(dimethylsulfamoyl)-2-benzimidazolyl]-N-(3-pyridinylmethyl)propanamide IUPAC Name: 3-[1-butyl-5-(dimethylsulfamoyl)benzimidazol-2-yl]-N-(pyridin-3-ylmethyl)propanamide Traditional Name: 3-[1-butyl-5-(dimethylsulfamoyl)benzimidazol-2-yl]-N-(3-pyridylmethyl)propionamide Formula: C22H29N5O3S MolecularWeight: 443.56236

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N(C)C)N=C1CCC(=O)NCC3=CN=CC=C3

Isomeric SMILES

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N(C)C)N=C1CCC(=O)NCC3=CN=CC=C3

InChI

InChI=1S/C22H29N5O3S/c1-4-5-13-27-20-9-8-18(31(29,30)26(2)3)14-19(20)25-21(27)10-11-22(28)24-16-17-7-6-12-23-15-17/h6-9,12,14-15H,4-5,10-11,13,16H2,1-3H3,(H,24,28)