N-[(4-chloranylpyridin-2-yl)carbamothioyl]adamantane-1-carboxamide

Systemtic Name: N-[(4-chloranylpyridin-2-yl)carbamothioyl]adamantane-1-carboxamide Openeye Name: N-[(4-chloro-2-pyridyl)carbamothioyl]adamantane-1-carboxamide CAS Name: N-[[(4-chloro-2-pyridinyl)amino]-sulfanylidenemethyl]-1-adamantanecarboxamide IUPAC Name: N-[(4-chloropyridin-2-yl)carbamothioyl]adamantane-1-carboxamide Traditional Name: N-[(4-chloro-2-pyridyl)thiocarbamoyl]adamantane-1-carboxamide Formula: C17H20ClN3OS MolecularWeight: 349.8782

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(=O)NC(=S)NC4=NC=CC(=C4)Cl

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(=O)NC(=S)NC4=NC=CC(=C4)Cl

InChI

InChI=1S/C17H20ClN3OS/c18-13-1-2-19-14(6-13)20-16(23)21-15(22)17-7-10-3-11(8-17)5-12(4-10)9-17/h1-2,6,10-12H,3-5,7-9H2,(H2,19,20,21,22,23)