N-(2-ethylphenyl)-2-[[4-ethyl-5-(phenylsulfanylmethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanamide

Systemtic Name: N-(2-ethylphenyl)-2-[[4-ethyl-5-(phenylsulfanylmethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: N-(2-ethylphenyl)-2-[[4-ethyl-5-(phenylsulfanylmethyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: N-(2-ethylphenyl)-2-[[4-ethyl-5-[(phenylthio)methyl]-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N-(2-ethylphenyl)-2-[[4-ethyl-5-(phenylsulfanylmethyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: N-(2-ethylphenyl)-2-[[4-ethyl-5-[(phenylthio)methyl]-1,2,4-triazol-3-yl]thio]acetamide Formula: C21H24N4OS2 MolecularWeight: 412.57146

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=O)CSC2=NN=C(N2CC)CSC3=CC=CC=C3

Isomeric SMILES

CCC1=CC=CC=C1NC(=O)CSC2=NN=C(N2CC)CSC3=CC=CC=C3

InChI

InChI=1S/C21H24N4OS2/c1-3-16-10-8-9-13-18(16)22-20(26)15-28-21-24-23-19(25(21)4-2)14-27-17-11-6-5-7-12-17/h5-13H,3-4,14-15H2,1-2H3,(H,22,26)