N-[4-(1H-1,2,4-triazol-5-ylsulfanyl)phenyl]piperidine-3-carboxamide

Systemtic Name: N-[4-(1H-1,2,4-triazol-5-ylsulfanyl)phenyl]piperidine-3-carboxamide Openeye Name: N-[4-(1H-1,2,4-triazol-5-ylsulfanyl)phenyl]piperidine-3-carboxamide CAS Name: N-[4-(1H-1,2,4-triazol-5-ylthio)phenyl]-3-piperidinecarboxamide IUPAC Name: N-[4-(1H-1,2,4-triazol-5-ylsulfanyl)phenyl]piperidine-3-carboxamide Traditional Name: N-[4-(1H-1,2,4-triazol-5-ylthio)phenyl]nipecotamide Formula: C14H17N5OS MolecularWeight: 303.38268

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CNC1)C(=O)NC2=CC=C(C=C2)SC3=NC=NN3

Isomeric SMILES

C1CC(CNC1)C(=O)NC2=CC=C(C=C2)SC3=NC=NN3

InChI

InChI=1S/C14H17N5OS/c20-13(10-2-1-7-15-8-10)18-11-3-5-12(6-4-11)21-14-16-9-17-19-14/h3-6,9-10,15H,1-2,7-8H2,(H,18,20)(H,16,17,19)