3-[(5-ethyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-pyridin-2-yl-propanamide

Systemtic Name: 3-[(5-ethyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-pyridin-2-yl-propanamide Openeye Name: 3-[(5-ethyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-(2-pyridyl)propanamide CAS Name: 3-[(5-ethyl-4-phenyl-1,2,4-triazol-3-yl)thio]-N-(2-pyridinyl)propanamide IUPAC Name: 3-[(5-ethyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-pyridin-2-ylpropanamide Traditional Name: 3-[(5-ethyl-4-phenyl-1,2,4-triazol-3-yl)thio]-N-(2-pyridyl)propionamide Formula: C18H19N5OS MolecularWeight: 353.44136

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN=C(N1C2=CC=CC=C2)SCCC(=O)NC3=CC=CC=N3

Isomeric SMILES

CCC1=NN=C(N1C2=CC=CC=C2)SCCC(=O)NC3=CC=CC=N3

InChI

InChI=1S/C18H19N5OS/c1-2-16-21-22-18(23(16)14-8-4-3-5-9-14)25-13-11-17(24)20-15-10-6-7-12-19-15/h3-10,12H,2,11,13H2,1H3,(H,19,20,24)