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

Systemtic Name: N-[2-(azepan-1-yl)phenyl]-3-[5-(dimethylsulfamoyl)-1-ethyl-benzimidazol-2-yl]propanamide Openeye Name: N-[2-(azepan-1-yl)phenyl]-3-[5-(dimethylsulfamoyl)-1-ethyl-benzimidazol-2-yl]propanamide CAS Name: N-[2-(1-azepanyl)phenyl]-3-[5-(dimethylsulfamoyl)-1-ethyl-2-benzimidazolyl]propanamide IUPAC Name: N-[2-(azepan-1-yl)phenyl]-3-[5-(dimethylsulfamoyl)-1-ethylbenzimidazol-2-yl]propanamide Traditional Name: N-[2-(azepan-1-yl)phenyl]-3-[5-(dimethylsulfamoyl)-1-ethyl-benzimidazol-2-yl]propionamide Formula: C26H35N5O3S MolecularWeight: 497.6528

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N(C)C)N=C1CCC(=O)NC3=CC=CC=C3N4CCCCCC4

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N(C)C)N=C1CCC(=O)NC3=CC=CC=C3N4CCCCCC4

InChI

InChI=1S/C26H35N5O3S/c1-4-31-24-14-13-20(35(33,34)29(2)3)19-22(24)27-25(31)15-16-26(32)28-21-11-7-8-12-23(21)30-17-9-5-6-10-18-30/h7-8,11-14,19H,4-6,9-10,15-18H2,1-3H3,(H,28,32)