1-adamantyl-[4-[2-(1H-imidazol-2-ylsulfanyl)ethyl]piperidin-1-yl]methanone

Systemtic Name: 1-adamantyl-[4-[2-(1H-imidazol-2-ylsulfanyl)ethyl]piperidin-1-yl]methanone Openeye Name: 1-adamantyl-[4-[2-(1H-imidazol-2-ylsulfanyl)ethyl]-1-piperidyl]methanone CAS Name: 1-adamantyl-[4-[2-(1H-imidazol-2-ylthio)ethyl]-1-piperidinyl]methanone IUPAC Name: 1-adamantyl-[4-[2-(1H-imidazol-2-ylsulfanyl)ethyl]piperidin-1-yl]methanone Traditional Name: 1-adamantyl-[4-[2-(1H-imidazol-2-ylthio)ethyl]piperidino]methanone Formula: C21H31N3OS MolecularWeight: 373.55534

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CCSC2=NC=CN2)C(=O)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

C1CN(CCC1CCSC2=NC=CN2)C(=O)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C21H31N3OS/c25-19(21-12-16-9-17(13-21)11-18(10-16)14-21)24-6-1-15(2-7-24)3-8-26-20-22-4-5-23-20/h4-5,15-18H,1-3,6-14H2,(H,22,23)