N-(1-adamantyl)-2-(1H-benzimidazol-2-ylsulfanyl)-N-(2-cyanoethyl)ethanamide

Systemtic Name: N-(1-adamantyl)-2-(1H-benzimidazol-2-ylsulfanyl)-N-(2-cyanoethyl)ethanamide Openeye Name: N-(1-adamantyl)-2-(1H-benzimidazol-2-ylsulfanyl)-N-(2-cyanoethyl)acetamide CAS Name: N-(1-adamantyl)-2-(1H-benzimidazol-2-ylthio)-N-(2-cyanoethyl)acetamide IUPAC Name: N-(1-adamantyl)-2-(1H-benzimidazol-2-ylsulfanyl)-N-(2-cyanoethyl)acetamide Traditional Name: N-(1-adamantyl)-2-(1H-benzimidazol-2-ylthio)-N-(2-cyanoethyl)acetamide Formula: C22H26N4OS MolecularWeight: 394.53304

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)N(CCC#N)C(=O)CSC4=NC5=CC=CC=C5N4

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)N(CCC#N)C(=O)CSC4=NC5=CC=CC=C5N4

InChI

InChI=1S/C22H26N4OS/c23-6-3-7-26(22-11-15-8-16(12-22)10-17(9-15)13-22)20(27)14-28-21-24-18-4-1-2-5-19(18)25-21/h1-2,4-5,15-17H,3,7-14H2,(H,24,25)