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

Systemtic Name: 2-[[4-butyl-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-(3-ethanoylphenyl)ethanamide Openeye Name: N-(3-acetylphenyl)-2-[[4-butyl-5-(2-furyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: N-(3-acetylphenyl)-2-[[4-butyl-5-(2-furanyl)-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N-(3-acetylphenyl)-2-[[4-butyl-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: N-(3-acetylphenyl)-2-[[4-butyl-5-(2-furyl)-1,2,4-triazol-3-yl]thio]acetamide Formula: C20H22N4O3S MolecularWeight: 398.47868

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=NN=C1SCC(=O)NC2=CC=CC(=C2)C(=O)C)C3=CC=CO3

Isomeric SMILES

CCCCN1C(=NN=C1SCC(=O)NC2=CC=CC(=C2)C(=O)C)C3=CC=CO3

InChI

InChI=1S/C20H22N4O3S/c1-3-4-10-24-19(17-9-6-11-27-17)22-23-20(24)28-13-18(26)21-16-8-5-7-15(12-16)14(2)25/h5-9,11-12H,3-4,10,13H2,1-2H3,(H,21,26)