1-(4-bromophenyl)-4-[[5-(2-methylphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]butan-1-one

Systemtic Name: 1-(4-bromophenyl)-4-[[5-(2-methylphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]butan-1-one Openeye Name: 1-(4-bromophenyl)-4-[[5-(o-tolyl)-1,3,4-oxadiazol-2-yl]sulfanyl]butan-1-one CAS Name: 1-(4-bromophenyl)-4-[[5-(2-methylphenyl)-1,3,4-oxadiazol-2-yl]thio]-1-butanone IUPAC Name: 1-(4-bromophenyl)-4-[[5-(2-methylphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]butan-1-one Traditional Name: 1-(4-bromophenyl)-4-[[5-(o-tolyl)-1,3,4-oxadiazol-2-yl]thio]butan-1-one Formula: C19H17BrN2O2S MolecularWeight: 417.31948

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=NN=C(O2)SCCCC(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

CC1=CC=CC=C1C2=NN=C(O2)SCCCC(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C19H17BrN2O2S/c1-13-5-2-3-6-16(13)18-21-22-19(24-18)25-12-4-7-17(23)14-8-10-15(20)11-9-14/h2-3,5-6,8-11H,4,7,12H2,1H3