N-(1-adamantylcarbamoyl)-3-[2-(hydroxymethyl)benzimidazol-1-yl]propanamide

Systemtic Name: N-(1-adamantylcarbamoyl)-3-[2-(hydroxymethyl)benzimidazol-1-yl]propanamide Openeye Name: N-(1-adamantylcarbamoyl)-3-[2-(hydroxymethyl)benzimidazol-1-yl]propanamide CAS Name: N-[(1-adamantylamino)-oxomethyl]-3-[2-(hydroxymethyl)-1-benzimidazolyl]propanamide IUPAC Name: N-(1-adamantylcarbamoyl)-3-[2-(hydroxymethyl)benzimidazol-1-yl]propanamide Traditional Name: N-(1-adamantylcarbamoyl)-3-(2-methylolbenzimidazol-1-yl)propionamide Formula: C22H28N4O3 MolecularWeight: 396.48272

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)NC(=O)NC(=O)CCN4C5=CC=CC=C5N=C4CO

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)NC(=O)NC(=O)CCN4C5=CC=CC=C5N=C4CO

InChI

InChI=1S/C22H28N4O3/c27-13-19-23-17-3-1-2-4-18(17)26(19)6-5-20(28)24-21(29)25-22-10-14-7-15(11-22)9-16(8-14)12-22/h1-4,14-16,27H,5-13H2,(H2,24,25,28,29)