N-(1-adamantyl)-2-[1-(3-chlorophenyl)imidazol-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(1-adamantyl)-2-[1-(3-chlorophenyl)imidazol-2-yl]sulfanyl-ethanamide Openeye Name: N-(1-adamantyl)-2-[1-(3-chlorophenyl)imidazol-2-yl]sulfanyl-acetamide CAS Name: N-(1-adamantyl)-2-[[1-(3-chlorophenyl)-2-imidazolyl]thio]acetamide IUPAC Name: N-(1-adamantyl)-2-[1-(3-chlorophenyl)imidazol-2-yl]sulfanylacetamide Traditional Name: N-(1-adamantyl)-2-[[1-(3-chlorophenyl)imidazol-2-yl]thio]acetamide Formula: C21H24ClN3OS MolecularWeight: 401.95276

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)NC(=O)CSC4=NC=CN4C5=CC(=CC=C5)Cl

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)NC(=O)CSC4=NC=CN4C5=CC(=CC=C5)Cl

InChI

InChI=1S/C21H24ClN3OS/c22-17-2-1-3-18(9-17)25-5-4-23-20(25)27-13-19(26)24-21-10-14-6-15(11-21)8-16(7-14)12-21/h1-5,9,14-16H,6-8,10-13H2,(H,24,26)