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

Systemtic Name: N-(2-phenylpropyl)-2-[(5-thiophen-2-yl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: N-(2-phenylpropyl)-2-[[5-(2-thienyl)-1H-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: N-(2-phenylpropyl)-2-[(5-thiophen-2-yl-1H-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: N-(2-phenylpropyl)-2-[(5-thiophen-2-yl-1H-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: N-(2-phenylpropyl)-2-[[5-(2-thienyl)-1H-1,2,4-triazol-3-yl]thio]acetamide Formula: C17H18N4OS2 MolecularWeight: 358.48102

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNC(=O)CSC1=NNC(=N1)C2=CC=CS2)C3=CC=CC=C3

Isomeric SMILES

CC(CNC(=O)CSC1=NNC(=N1)C2=CC=CS2)C3=CC=CC=C3

InChI

InChI=1S/C17H18N4OS2/c1-12(13-6-3-2-4-7-13)10-18-15(22)11-24-17-19-16(20-21-17)14-8-5-9-23-14/h2-9,12H,10-11H2,1H3,(H,18,22)(H,19,20,21)