2-(1-adamantyl)-N-[(3-chloranyl-2-piperidin-1-yl-phenyl)carbamothioyl]ethanamide

Systemtic Name: 2-(1-adamantyl)-N-[(3-chloranyl-2-piperidin-1-yl-phenyl)carbamothioyl]ethanamide Openeye Name: 2-(1-adamantyl)-N-[[3-chloro-2-(1-piperidyl)phenyl]carbamothioyl]acetamide CAS Name: 2-(1-adamantyl)-N-[[3-chloro-2-(1-piperidinyl)anilino]-sulfanylidenemethyl]acetamide IUPAC Name: 2-(1-adamantyl)-N-[(3-chloro-2-piperidin-1-ylphenyl)carbamothioyl]acetamide Traditional Name: 2-(1-adamantyl)-N-[(3-chloro-2-piperidino-phenyl)thiocarbamoyl]acetamide Formula: C24H32ClN3OS MolecularWeight: 446.04838

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C=CC=C2Cl)NC(=S)NC(=O)CC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

C1CCN(CC1)C2=C(C=CC=C2Cl)NC(=S)NC(=O)CC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C24H32ClN3OS/c25-19-5-4-6-20(22(19)28-7-2-1-3-8-28)26-23(30)27-21(29)15-24-12-16-9-17(13-24)11-18(10-16)14-24/h4-6,16-18H,1-3,7-15H2,(H2,26,27,29,30)