N-(pyrimidin-2-ylcarbamothioyl)adamantane-1-carboxamide

Systemtic Name: N-(pyrimidin-2-ylcarbamothioyl)adamantane-1-carboxamide Openeye Name: N-(pyrimidin-2-ylcarbamothioyl)adamantane-1-carboxamide CAS Name: N-[(2-pyrimidinylamino)-sulfanylidenemethyl]-1-adamantanecarboxamide IUPAC Name: N-(pyrimidin-2-ylcarbamothioyl)adamantane-1-carboxamide Traditional Name: N-(2-pyrimidylthiocarbamoyl)adamantane-1-carboxamide Formula: C16H20N4OS MolecularWeight: 316.4212

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(=O)NC(=S)NC4=NC=CC=N4

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(=O)NC(=S)NC4=NC=CC=N4

InChI

InChI=1S/C16H20N4OS/c21-13(19-15(22)20-14-17-2-1-3-18-14)16-7-10-4-11(8-16)6-12(5-10)9-16/h1-3,10-12H,4-9H2,(H2,17,18,19,20,21,22)