1-[4-[(4-chlorophenyl)sulfanylmethyl]phenyl]carbonyl-N-propyl-piperidine-4-carboxamide

Systemtic Name: 1-[4-[(4-chlorophenyl)sulfanylmethyl]phenyl]carbonyl-N-propyl-piperidine-4-carboxamide Openeye Name: 1-[4-[(4-chlorophenyl)sulfanylmethyl]benzoyl]-N-propyl-piperidine-4-carboxamide CAS Name: 1-[[4-[[(4-chlorophenyl)thio]methyl]phenyl]-oxomethyl]-N-propyl-4-piperidinecarboxamide IUPAC Name: 1-[4-[(4-chlorophenyl)sulfanylmethyl]benzoyl]-N-propylpiperidine-4-carboxamide Traditional Name: 1-[4-[[(4-chlorophenyl)thio]methyl]benzoyl]-N-propyl-isonipecotamide Formula: C23H27ClN2O2S MolecularWeight: 430.99068

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C1CCN(CC1)C(=O)C2=CC=C(C=C2)CSC3=CC=C(C=C3)Cl

Isomeric SMILES

CCCNC(=O)C1CCN(CC1)C(=O)C2=CC=C(C=C2)CSC3=CC=C(C=C3)Cl

InChI

InChI=1S/C23H27ClN2O2S/c1-2-13-25-22(27)18-11-14-26(15-12-18)23(28)19-5-3-17(4-6-19)16-29-21-9-7-20(24)8-10-21/h3-10,18H,2,11-16H2,1H3,(H,25,27)