N-(pyridin-4-ylcarbamothioyl)adamantane-1-carboxamide

Systemtic Name: N-(pyridin-4-ylcarbamothioyl)adamantane-1-carboxamide Openeye Name: N-(4-pyridylcarbamothioyl)adamantane-1-carboxamide CAS Name: N-[(pyridin-4-ylamino)-sulfanylidenemethyl]-1-adamantanecarboxamide IUPAC Name: N-(pyridin-4-ylcarbamothioyl)adamantane-1-carboxamide Traditional Name: N-(4-pyridylthiocarbamoyl)adamantane-1-carboxamide Formula: C17H21N3OS MolecularWeight: 315.43314

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H21N3OS/c21-15(20-16(22)19-14-1-3-18-4-2-14)17-8-11-5-12(9-17)7-13(6-11)10-17/h1-4,11-13H,5-10H2,(H2,18,19,20,21,22)