N-[2-(4-tert-butylphenyl)ethyl]-2-[(4-ethyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]ethanamide

Systemtic Name: N-[2-(4-tert-butylphenyl)ethyl]-2-[(4-ethyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: N-[2-(4-tert-butylphenyl)ethyl]-2-[[4-ethyl-5-(2-thienyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: N-[2-(4-tert-butylphenyl)ethyl]-2-[(4-ethyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: N-[2-(4-tert-butylphenyl)ethyl]-2-[(4-ethyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: N-[2-(4-tert-butylphenyl)ethyl]-2-[[4-ethyl-5-(2-thienyl)-1,2,4-triazol-3-yl]thio]acetamide Formula: C22H28N4OS2 MolecularWeight: 428.61392

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC(=O)NCCC2=CC=C(C=C2)C(C)(C)C)C3=CC=CS3

Isomeric SMILES

CCN1C(=NN=C1SCC(=O)NCCC2=CC=C(C=C2)C(C)(C)C)C3=CC=CS3

InChI

InChI=1S/C22H28N4OS2/c1-5-26-20(18-7-6-14-28-18)24-25-21(26)29-15-19(27)23-13-12-16-8-10-17(11-9-16)22(2,3)4/h6-11,14H,5,12-13,15H2,1-4H3,(H,23,27)