N-(1-adamantylcarbamoyl)-2-(1-butyl-4,5-dimethyl-imidazol-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(1-adamantylcarbamoyl)-2-(1-butyl-4,5-dimethyl-imidazol-2-yl)sulfanyl-ethanamide Openeye Name: N-(1-adamantylcarbamoyl)-2-(1-butyl-4,5-dimethyl-imidazol-2-yl)sulfanyl-acetamide CAS Name: N-[(1-adamantylamino)-oxomethyl]-2-[(1-butyl-4,5-dimethyl-2-imidazolyl)thio]acetamide IUPAC Name: N-(1-adamantylcarbamoyl)-2-(1-butyl-4,5-dimethylimidazol-2-yl)sulfanylacetamide Traditional Name: N-(1-adamantylcarbamoyl)-2-[(1-butyl-4,5-dimethyl-imidazol-2-yl)thio]acetamide Formula: C22H34N4O2S MolecularWeight: 418.59596

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(N=C1SCC(=O)NC(=O)NC23CC4CC(C2)CC(C4)C3)C)C

Isomeric SMILES

CCCCN1C(=C(N=C1SCC(=O)NC(=O)NC23CC4CC(C2)CC(C4)C3)C)C

InChI

InChI=1S/C22H34N4O2S/c1-4-5-6-26-15(3)14(2)23-21(26)29-13-19(27)24-20(28)25-22-10-16-7-17(11-22)9-18(8-16)12-22/h16-18H,4-13H2,1-3H3,(H2,24,25,27,28)