N-(1-adamantyl)-2-(1-methyl-5-phenyl-imidazol-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(1-adamantyl)-2-(1-methyl-5-phenyl-imidazol-2-yl)sulfanyl-ethanamide Openeye Name: N-(1-adamantyl)-2-(1-methyl-5-phenyl-imidazol-2-yl)sulfanyl-acetamide CAS Name: N-(1-adamantyl)-2-[(1-methyl-5-phenyl-2-imidazolyl)thio]acetamide IUPAC Name: N-(1-adamantyl)-2-(1-methyl-5-phenylimidazol-2-yl)sulfanylacetamide Traditional Name: N-(1-adamantyl)-2-[(1-methyl-5-phenyl-imidazol-2-yl)thio]acetamide Formula: C22H27N3OS MolecularWeight: 381.53428

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CN=C1SCC(=O)NC23CC4CC(C2)CC(C4)C3)C5=CC=CC=C5

Isomeric SMILES

CN1C(=CN=C1SCC(=O)NC23CC4CC(C2)CC(C4)C3)C5=CC=CC=C5

InChI

InChI=1S/C22H27N3OS/c1-25-19(18-5-3-2-4-6-18)13-23-21(25)27-14-20(26)24-22-10-15-7-16(11-22)9-17(8-15)12-22/h2-6,13,15-17H,7-12,14H2,1H3,(H,24,26)