2-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-propyl-ethanamide

Systemtic Name: 2-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-propyl-ethanamide Openeye Name: 2-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-propyl-acetamide CAS Name: 2-[(5-phenyl-1H-1,2,4-triazol-3-yl)thio]-N-propylacetamide IUPAC Name: 2-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-propylacetamide Traditional Name: 2-[(5-phenyl-1H-1,2,4-triazol-3-yl)thio]-N-propyl-acetamide Formula: C13H16N4OS MolecularWeight: 276.35734

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)CSC1=NNC(=N1)C2=CC=CC=C2

Isomeric SMILES

CCCNC(=O)CSC1=NNC(=N1)C2=CC=CC=C2

InChI

InChI=1S/C13H16N4OS/c1-2-8-14-11(18)9-19-13-15-12(16-17-13)10-6-4-3-5-7-10/h3-7H,2,8-9H2,1H3,(H,14,18)(H,15,16,17)