2-[[5-(3,4-dimethoxyphenyl)-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]-N-(5-fluoranyl-2-methyl-phenyl)ethanamide

Systemtic Name: 2-[[5-(3,4-dimethoxyphenyl)-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]-N-(5-fluoranyl-2-methyl-phenyl)ethanamide Openeye Name: 2-[[5-(3,4-dimethoxyphenyl)-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]-N-(5-fluoro-2-methyl-phenyl)acetamide CAS Name: 2-[[5-(3,4-dimethoxyphenyl)-4-ethyl-1,2,4-triazol-3-yl]thio]-N-(5-fluoro-2-methylphenyl)acetamide IUPAC Name: 2-[[5-(3,4-dimethoxyphenyl)-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]-N-(5-fluoro-2-methylphenyl)acetamide Traditional Name: 2-[[5-(3,4-dimethoxyphenyl)-4-ethyl-1,2,4-triazol-3-yl]thio]-N-(5-fluoro-2-methyl-phenyl)acetamide Formula: C21H23FN4O3S MolecularWeight: 430.495723

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC(=O)NC2=C(C=CC(=C2)F)C)C3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CCN1C(=NN=C1SCC(=O)NC2=C(C=CC(=C2)F)C)C3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C21H23FN4O3S/c1-5-26-20(14-7-9-17(28-3)18(10-14)29-4)24-25-21(26)30-12-19(27)23-16-11-15(22)8-6-13(16)2/h6-11H,5,12H2,1-4H3,(H,23,27)