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

Systemtic Name: N-(2-ethanoylphenyl)-2-[[5-(phenoxymethyl)-1H-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: N-(2-acetylphenyl)-2-[[5-(phenoxymethyl)-1H-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: N-(2-acetylphenyl)-2-[[5-(phenoxymethyl)-1H-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N-(2-acetylphenyl)-2-[[5-(phenoxymethyl)-1H-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: N-(2-acetylphenyl)-2-[[5-(phenoxymethyl)-1H-1,2,4-triazol-3-yl]thio]acetamide Formula: C19H18N4O3S MolecularWeight: 382.43622

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=CC=C1NC(=O)CSC2=NNC(=N2)COC3=CC=CC=C3

Isomeric SMILES

CC(=O)C1=CC=CC=C1NC(=O)CSC2=NNC(=N2)COC3=CC=CC=C3

InChI

InChI=1S/C19H18N4O3S/c1-13(24)15-9-5-6-10-16(15)20-18(25)12-27-19-21-17(22-23-19)11-26-14-7-3-2-4-8-14/h2-10H,11-12H2,1H3,(H,20,25)(H,21,22,23)