N-phenyl-1-[2-(1H-1,2,4-triazol-5-ylsulfanyl)ethanoyl]piperidine-4-carboxamide

Systemtic Name: N-phenyl-1-[2-(1H-1,2,4-triazol-5-ylsulfanyl)ethanoyl]piperidine-4-carboxamide Openeye Name: N-phenyl-1-[2-(1H-1,2,4-triazol-5-ylsulfanyl)acetyl]piperidine-4-carboxamide CAS Name: 1-[1-oxo-2-(1H-1,2,4-triazol-5-ylthio)ethyl]-N-phenyl-4-piperidinecarboxamide IUPAC Name: N-phenyl-1-[2-(1H-1,2,4-triazol-5-ylsulfanyl)acetyl]piperidine-4-carboxamide Traditional Name: N-phenyl-1-[2-(1H-1,2,4-triazol-5-ylthio)acetyl]isonipecotamide Formula: C16H19N5O2S MolecularWeight: 345.41936

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=CC=CC=C2)C(=O)CSC3=NC=NN3

Isomeric SMILES

C1CN(CCC1C(=O)NC2=CC=CC=C2)C(=O)CSC3=NC=NN3

InChI

InChI=1S/C16H19N5O2S/c22-14(10-24-16-17-11-18-20-16)21-8-6-12(7-9-21)15(23)19-13-4-2-1-3-5-13/h1-5,11-12H,6-10H2,(H,19,23)(H,17,18,20)