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

Systemtic Name: 2-[[4-ethyl-5-(4-ethyl-5-methyl-thiophen-3-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenethyl-ethanamide Openeye Name: 2-[[4-ethyl-5-(4-ethyl-5-methyl-3-thienyl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenethyl-acetamide CAS Name: 2-[[4-ethyl-5-(4-ethyl-5-methyl-3-thiophenyl)-1,2,4-triazol-3-yl]thio]-N-phenethylacetamide IUPAC Name: 2-[[4-ethyl-5-(4-ethyl-5-methylthiophen-3-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenethylacetamide Traditional Name: 2-[[4-ethyl-5-(4-ethyl-5-methyl-3-thienyl)-1,2,4-triazol-3-yl]thio]-N-phenethyl-acetamide Formula: C21H26N4OS2 MolecularWeight: 414.58734

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC=C1C2=NN=C(N2CC)SCC(=O)NCCC3=CC=CC=C3)C

Isomeric SMILES

CCC1=C(SC=C1C2=NN=C(N2CC)SCC(=O)NCCC3=CC=CC=C3)C

InChI

InChI=1S/C21H26N4OS2/c1-4-17-15(3)27-13-18(17)20-23-24-21(25(20)5-2)28-14-19(26)22-12-11-16-9-7-6-8-10-16/h6-10,13H,4-5,11-12,14H2,1-3H3,(H,22,26)