N-[(3-chlorophenyl)carbamothioyl]adamantane-1-carboxamide

Systemtic Name: N-[(3-chlorophenyl)carbamothioyl]adamantane-1-carboxamide Openeye Name: N-[(3-chlorophenyl)carbamothioyl]adamantane-1-carboxamide CAS Name: N-[(3-chloroanilino)-sulfanylidenemethyl]-1-adamantanecarboxamide IUPAC Name: N-[(3-chlorophenyl)carbamothioyl]adamantane-1-carboxamide Traditional Name: N-[(3-chlorophenyl)thiocarbamoyl]adamantane-1-carboxamide Formula: C18H21ClN2OS MolecularWeight: 348.89014

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H21ClN2OS/c19-14-2-1-3-15(7-14)20-17(23)21-16(22)18-8-11-4-12(9-18)6-13(5-11)10-18/h1-3,7,11-13H,4-6,8-10H2,(H2,20,21,22,23)