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

Systemtic Name: 2-[[5-(2-ethoxyphenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-N-phenyl-ethanamide Openeye Name: 2-[[5-(2-ethoxyphenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-N-phenyl-acetamide CAS Name: 2-[[5-(2-ethoxyphenyl)-1H-1,2,4-triazol-3-yl]thio]-N-phenylacetamide IUPAC Name: 2-[[5-(2-ethoxyphenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide Traditional Name: 2-[(5-o-phenetyl-1H-1,2,4-triazol-3-yl)thio]-N-phenyl-acetamide Formula: C18H18N4O2S MolecularWeight: 354.42612

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1C2=NC(=NN2)SCC(=O)NC3=CC=CC=C3

Isomeric SMILES

CCOC1=CC=CC=C1C2=NC(=NN2)SCC(=O)NC3=CC=CC=C3

InChI

InChI=1S/C18H18N4O2S/c1-2-24-15-11-7-6-10-14(15)17-20-18(22-21-17)25-12-16(23)19-13-8-4-3-5-9-13/h3-11H,2,12H2,1H3,(H,19,23)(H,20,21,22)