N-[naphthalen-2-yl(phenyl)carbamothioyl]adamantane-1-carboxamide

Systemtic Name: N-[naphthalen-2-yl(phenyl)carbamothioyl]adamantane-1-carboxamide Openeye Name: N-[2-naphthyl(phenyl)carbamothioyl]adamantane-1-carboxamide CAS Name: N-[[N-(2-naphthalenyl)anilino]-sulfanylidenemethyl]-1-adamantanecarboxamide IUPAC Name: N-[naphthalen-2-yl(phenyl)carbamothioyl]adamantane-1-carboxamide Traditional Name: N-[2-naphthyl(phenyl)thiocarbamoyl]adamantane-1-carboxamide Formula: C28H28N2OS MolecularWeight: 440.59972

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(=O)NC(=S)N(C4=CC=CC=C4)C5=CC6=CC=CC=C6C=C5

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(=O)NC(=S)N(C4=CC=CC=C4)C5=CC6=CC=CC=C6C=C5

InChI

InChI=1S/C28H28N2OS/c31-26(28-16-19-12-20(17-28)14-21(13-19)18-28)29-27(32)30(24-8-2-1-3-9-24)25-11-10-22-6-4-5-7-23(22)15-25/h1-11,15,19-21H,12-14,16-18H2,(H,29,31,32)