(3S)-1-[(4-chlorophenyl)carbamothioyl]-N,N-diethyl-piperidine-3-carboxamide

Systemtic Name: (3S)-1-[(4-chlorophenyl)carbamothioyl]-N,N-diethyl-piperidine-3-carboxamide Openeye Name: (3S)-1-[(4-chlorophenyl)carbamothioyl]-N,N-diethyl-piperidine-3-carboxamide CAS Name: (3S)-1-[(4-chloroanilino)-sulfanylidenemethyl]-N,N-diethyl-3-piperidinecarboxamide IUPAC Name: (3S)-1-[(4-chlorophenyl)carbamothioyl]-N,N-diethylpiperidine-3-carboxamide Traditional Name: (3S)-1-[(4-chlorophenyl)thiocarbamoyl]-N,N-diethyl-nipecotamide Formula: C17H24ClN3OS MolecularWeight: 353.90996

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1CCCN(C1)C(=S)NC2=CC=C(C=C2)Cl

Isomeric SMILES

CCN(CC)C(=O)[C@H]1CCCN(C1)C(=S)NC2=CC=C(C=C2)Cl

InChI

InChI=1S/C17H24ClN3OS/c1-3-20(4-2)16(22)13-6-5-11-21(12-13)17(23)19-15-9-7-14(18)8-10-15/h7-10,13H,3-6,11-12H2,1-2H3,(H,19,23)/t13-/m0/s1