N-[1-(1-adamantyl)ethyl]-3-[5-(dimethylsulfamoyl)-1-methyl-benzimidazol-2-yl]propanamide

Systemtic Name: N-[1-(1-adamantyl)ethyl]-3-[5-(dimethylsulfamoyl)-1-methyl-benzimidazol-2-yl]propanamide Openeye Name: N-[1-(1-adamantyl)ethyl]-3-[5-(dimethylsulfamoyl)-1-methyl-benzimidazol-2-yl]propanamide CAS Name: N-[1-(1-adamantyl)ethyl]-3-[5-(dimethylsulfamoyl)-1-methyl-2-benzimidazolyl]propanamide IUPAC Name: N-[1-(1-adamantyl)ethyl]-3-[5-(dimethylsulfamoyl)-1-methylbenzimidazol-2-yl]propanamide Traditional Name: N-[1-(1-adamantyl)ethyl]-3-[5-(dimethylsulfamoyl)-1-methyl-benzimidazol-2-yl]propionamide Formula: C25H36N4O3S MolecularWeight: 472.64334

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Descriptors Computed from Structure

Canonical SMILES:

CC(C12CC3CC(C1)CC(C3)C2)NC(=O)CCC4=NC5=C(N4C)C=CC(=C5)S(=O)(=O)N(C)C

Isomeric SMILES

CC(C12CC3CC(C1)CC(C3)C2)NC(=O)CCC4=NC5=C(N4C)C=CC(=C5)S(=O)(=O)N(C)C

InChI

InChI=1S/C25H36N4O3S/c1-16(25-13-17-9-18(14-25)11-19(10-17)15-25)26-24(30)8-7-23-27-21-12-20(33(31,32)28(2)3)5-6-22(21)29(23)4/h5-6,12,16-19H,7-11,13-15H2,1-4H3,(H,26,30)