1-(4-ethylphenyl)-2-[[4-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]ethanone

Systemtic Name: 1-(4-ethylphenyl)-2-[[4-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]ethanone Openeye Name: 1-(4-ethylphenyl)-2-[[4-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]ethanone CAS Name: 1-(4-ethylphenyl)-2-[[4-(4-methoxyphenyl)-1,2,4-triazol-3-yl]thio]ethanone IUPAC Name: 1-(4-ethylphenyl)-2-[[4-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]ethanone Traditional Name: 1-(4-ethylphenyl)-2-[[4-(4-methoxyphenyl)-1,2,4-triazol-3-yl]thio]ethanone Formula: C19H19N3O2S MolecularWeight: 353.43806

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)CSC2=NN=CN2C3=CC=C(C=C3)OC

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)CSC2=NN=CN2C3=CC=C(C=C3)OC

InChI

InChI=1S/C19H19N3O2S/c1-3-14-4-6-15(7-5-14)18(23)12-25-19-21-20-13-22(19)16-8-10-17(24-2)11-9-16/h4-11,13H,3,12H2,1-2H3