2-[[4-ethyl-5-(4-propan-2-ylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(3-methylphenyl)ethanamide

Systemtic Name: 2-[[4-ethyl-5-(4-propan-2-ylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(3-methylphenyl)ethanamide Openeye Name: 2-[[4-ethyl-5-(4-isopropylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(m-tolyl)acetamide CAS Name: 2-[[4-ethyl-5-(4-propan-2-ylphenyl)-1,2,4-triazol-3-yl]thio]-N-(3-methylphenyl)acetamide IUPAC Name: 2-[[4-ethyl-5-(4-propan-2-ylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(3-methylphenyl)acetamide Traditional Name: 2-[(4-ethyl-5-p-cumenyl-1,2,4-triazol-3-yl)thio]-N-(m-tolyl)acetamide Formula: C22H26N4OS MolecularWeight: 394.53304

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H26N4OS/c1-5-26-21(18-11-9-17(10-12-18)15(2)3)24-25-22(26)28-14-20(27)23-19-8-6-7-16(4)13-19/h6-13,15H,5,14H2,1-4H3,(H,23,27)