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

Systemtic Name: 1-(4-bromophenyl)-4-[(5-phenyl-1,3,4-oxadiazol-2-yl)sulfanyl]butan-1-one Openeye Name: 1-(4-bromophenyl)-4-[(5-phenyl-1,3,4-oxadiazol-2-yl)sulfanyl]butan-1-one CAS Name: 1-(4-bromophenyl)-4-[(5-phenyl-1,3,4-oxadiazol-2-yl)thio]-1-butanone IUPAC Name: 1-(4-bromophenyl)-4-[(5-phenyl-1,3,4-oxadiazol-2-yl)sulfanyl]butan-1-one Traditional Name: 1-(4-bromophenyl)-4-[(5-phenyl-1,3,4-oxadiazol-2-yl)thio]butan-1-one Formula: C18H15BrN2O2S MolecularWeight: 403.2929

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN=C(O2)SCCCC(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

C1=CC=C(C=C1)C2=NN=C(O2)SCCCC(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C18H15BrN2O2S/c19-15-10-8-13(9-11-15)16(22)7-4-12-24-18-21-20-17(23-18)14-5-2-1-3-6-14/h1-3,5-6,8-11H,4,7,12H2