2-(1-adamantyl)-N-(pyridin-3-ylmethylcarbamothioyl)ethanamide

Systemtic Name: 2-(1-adamantyl)-N-(pyridin-3-ylmethylcarbamothioyl)ethanamide Openeye Name: 2-(1-adamantyl)-N-(3-pyridylmethylcarbamothioyl)acetamide CAS Name: 2-(1-adamantyl)-N-[(3-pyridinylmethylamino)-sulfanylidenemethyl]acetamide IUPAC Name: 2-(1-adamantyl)-N-(pyridin-3-ylmethylcarbamothioyl)acetamide Traditional Name: 2-(1-adamantyl)-N-(3-pyridylmethylthiocarbamoyl)acetamide Formula: C19H25N3OS MolecularWeight: 343.4863

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)CC(=O)NC(=S)NCC4=CN=CC=C4

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)CC(=O)NC(=S)NCC4=CN=CC=C4

InChI

InChI=1S/C19H25N3OS/c23-17(22-18(24)21-12-13-2-1-3-20-11-13)10-19-7-14-4-15(8-19)6-16(5-14)9-19/h1-3,11,14-16H,4-10,12H2,(H2,21,22,23,24)