N-[2-(azepan-1-yl)phenyl]-3-[5-(dimethylsulfamoyl)-1-methyl-benzimidazol-2-yl]propanamide

Systemtic Name: N-[2-(azepan-1-yl)phenyl]-3-[5-(dimethylsulfamoyl)-1-methyl-benzimidazol-2-yl]propanamide Openeye Name: N-[2-(azepan-1-yl)phenyl]-3-[5-(dimethylsulfamoyl)-1-methyl-benzimidazol-2-yl]propanamide CAS Name: N-[2-(1-azepanyl)phenyl]-3-[5-(dimethylsulfamoyl)-1-methyl-2-benzimidazolyl]propanamide IUPAC Name: N-[2-(azepan-1-yl)phenyl]-3-[5-(dimethylsulfamoyl)-1-methylbenzimidazol-2-yl]propanamide Traditional Name: N-[2-(azepan-1-yl)phenyl]-3-[5-(dimethylsulfamoyl)-1-methyl-benzimidazol-2-yl]propionamide Formula: C25H33N5O3S MolecularWeight: 483.62622

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)S(=O)(=O)N(C)C)N=C1CCC(=O)NC3=CC=CC=C3N4CCCCCC4

Isomeric SMILES

CN1C2=C(C=C(C=C2)S(=O)(=O)N(C)C)N=C1CCC(=O)NC3=CC=CC=C3N4CCCCCC4

InChI

InChI=1S/C25H33N5O3S/c1-28(2)34(32,33)19-12-13-22-21(18-19)26-24(29(22)3)14-15-25(31)27-20-10-6-7-11-23(20)30-16-8-4-5-9-17-30/h6-7,10-13,18H,4-5,8-9,14-17H2,1-3H3,(H,27,31)