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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)C(=O)N)C(=O)CSC2=NNC(=N2)C3=CC=CC=C3

Isomeric SMILES

C1CCN([C@H](C1)C(=O)N)C(=O)CSC2=NNC(=N2)C3=CC=CC=C3

InChI

InChI=1S/C16H19N5O2S/c17-14(23)12-8-4-5-9-21(12)13(22)10-24-16-18-15(19-20-16)11-6-2-1-3-7-11/h1-3,6-7,12H,4-5,8-10H2,(H2,17,23)(H,18,19,20)/t12-/m1/s1