1-(4-butylphenyl)-2-[[5-(2-methylphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]ethanone

Systemtic Name: 1-(4-butylphenyl)-2-[[5-(2-methylphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]ethanone Openeye Name: 1-(4-butylphenyl)-2-[[5-(o-tolyl)-1,3,4-oxadiazol-2-yl]sulfanyl]ethanone CAS Name: 1-(4-butylphenyl)-2-[[5-(2-methylphenyl)-1,3,4-oxadiazol-2-yl]thio]ethanone IUPAC Name: 1-(4-butylphenyl)-2-[[5-(2-methylphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]ethanone Traditional Name: 1-(4-butylphenyl)-2-[[5-(o-tolyl)-1,3,4-oxadiazol-2-yl]thio]ethanone Formula: C21H22N2O2S MolecularWeight: 366.47658

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C(=O)CSC2=NN=C(O2)C3=CC=CC=C3C

Isomeric SMILES

CCCCC1=CC=C(C=C1)C(=O)CSC2=NN=C(O2)C3=CC=CC=C3C

InChI

InChI=1S/C21H22N2O2S/c1-3-4-8-16-10-12-17(13-11-16)19(24)14-26-21-23-22-20(25-21)18-9-6-5-7-15(18)2/h5-7,9-13H,3-4,8,14H2,1-2H3