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

Systemtic Name: N-(1-adamantyl)-2-(1-butyl-4,5-dimethyl-imidazol-2-yl)sulfanyl-ethanamide Openeye Name: N-(1-adamantyl)-2-(1-butyl-4,5-dimethyl-imidazol-2-yl)sulfanyl-acetamide CAS Name: N-(1-adamantyl)-2-[(1-butyl-4,5-dimethyl-2-imidazolyl)thio]acetamide IUPAC Name: N-(1-adamantyl)-2-(1-butyl-4,5-dimethylimidazol-2-yl)sulfanylacetamide Traditional Name: N-(1-adamantyl)-2-[(1-butyl-4,5-dimethyl-imidazol-2-yl)thio]acetamide Formula: C21H33N3OS MolecularWeight: 375.57122

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H33N3OS/c1-4-5-6-24-15(3)14(2)22-20(24)26-13-19(25)23-21-10-16-7-17(11-21)9-18(8-16)12-21/h16-18H,4-13H2,1-3H3,(H,23,25)