1-[2-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanoyl]piperidine-4-carboxamide

Systemtic Name: 1-[2-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanoyl]piperidine-4-carboxamide Openeye Name: 1-[2-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]acetyl]piperidine-4-carboxamide CAS Name: 1-[1-oxo-2-[(5-phenyl-1H-1,2,4-triazol-3-yl)thio]ethyl]-4-piperidinecarboxamide IUPAC Name: 1-[2-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]acetyl]piperidine-4-carboxamide Traditional Name: 1-[2-[(5-phenyl-1H-1,2,4-triazol-3-yl)thio]acetyl]isonipecotamide Formula: C16H19N5O2S MolecularWeight: 345.41936

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)N)C(=O)CSC2=NNC(=N2)C3=CC=CC=C3

Isomeric SMILES

C1CN(CCC1C(=O)N)C(=O)CSC2=NNC(=N2)C3=CC=CC=C3

InChI

InChI=1S/C16H19N5O2S/c17-14(23)11-6-8-21(9-7-11)13(22)10-24-16-18-15(19-20-16)12-4-2-1-3-5-12/h1-5,11H,6-10H2,(H2,17,23)(H,18,19,20)