N-(1-adamantyl)-2-[[5-(4-nitrophenyl)-1H-imidazol-2-yl]sulfanyl]ethanamide

Systemtic Name: N-(1-adamantyl)-2-[[5-(4-nitrophenyl)-1H-imidazol-2-yl]sulfanyl]ethanamide Openeye Name: N-(1-adamantyl)-2-[[5-(4-nitrophenyl)-1H-imidazol-2-yl]sulfanyl]acetamide CAS Name: N-(1-adamantyl)-2-[[5-(4-nitrophenyl)-1H-imidazol-2-yl]thio]acetamide IUPAC Name: N-(1-adamantyl)-2-[[5-(4-nitrophenyl)-1H-imidazol-2-yl]sulfanyl]acetamide Traditional Name: N-(1-adamantyl)-2-[[5-(4-nitrophenyl)-1H-imidazol-2-yl]thio]acetamide Formula: C21H24N4O3S MolecularWeight: 412.50526

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)NC(=O)CSC4=NC=C(N4)C5=CC=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)NC(=O)CSC4=NC=C(N4)C5=CC=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C21H24N4O3S/c26-19(24-21-8-13-5-14(9-21)7-15(6-13)10-21)12-29-20-22-11-18(23-20)16-1-3-17(4-2-16)25(27)28/h1-4,11,13-15H,5-10,12H2,(H,22,23)(H,24,26)