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

Systemtic Name: 1-[[5-(3-bromophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]-3,3-dimethyl-butan-2-one Openeye Name: 1-[[5-(3-bromophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]-3,3-dimethyl-butan-2-one CAS Name: 1-[[5-(3-bromophenyl)-1,3,4-oxadiazol-2-yl]thio]-3,3-dimethyl-2-butanone IUPAC Name: 1-[[5-(3-bromophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]-3,3-dimethylbutan-2-one Traditional Name: 1-[[5-(3-bromophenyl)-1,3,4-oxadiazol-2-yl]thio]-3,3-dimethyl-butan-2-one Formula: C14H15BrN2O2S MolecularWeight: 355.2501

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)CSC1=NN=C(O1)C2=CC(=CC=C2)Br

Isomeric SMILES

CC(C)(C)C(=O)CSC1=NN=C(O1)C2=CC(=CC=C2)Br

InChI

InChI=1S/C14H15BrN2O2S/c1-14(2,3)11(18)8-20-13-17-16-12(19-13)9-5-4-6-10(15)7-9/h4-7H,8H2,1-3H3