N-[1-[(4-chlorophenyl)carbamothioyl]piperidin-4-yl]adamantane-1-carboxamide

Systemtic Name: N-[1-[(4-chlorophenyl)carbamothioyl]piperidin-4-yl]adamantane-1-carboxamide Openeye Name: N-[1-[(4-chlorophenyl)carbamothioyl]-4-piperidyl]adamantane-1-carboxamide CAS Name: N-[1-[(4-chloroanilino)-sulfanylidenemethyl]-4-piperidinyl]-1-adamantanecarboxamide IUPAC Name: N-[1-[(4-chlorophenyl)carbamothioyl]piperidin-4-yl]adamantane-1-carboxamide Traditional Name: N-[1-[(4-chlorophenyl)thiocarbamoyl]-4-piperidyl]adamantane-1-carboxamide Formula: C23H30ClN3OS MolecularWeight: 432.0218

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NC(=O)C23CC4CC(C2)CC(C4)C3)C(=S)NC5=CC=C(C=C5)Cl

Isomeric SMILES

C1CN(CCC1NC(=O)C23CC4CC(C2)CC(C4)C3)C(=S)NC5=CC=C(C=C5)Cl

InChI

InChI=1S/C23H30ClN3OS/c24-18-1-3-19(4-2-18)26-22(29)27-7-5-20(6-8-27)25-21(28)23-12-15-9-16(13-23)11-17(10-15)14-23/h1-4,15-17,20H,5-14H2,(H,25,28)(H,26,29)