1-(4-bromophenyl)-4-tert-butylsulfanyl-butan-1-one

Systemtic Name: 1-(4-bromophenyl)-4-tert-butylsulfanyl-butan-1-one Openeye Name: 1-(4-bromophenyl)-4-tert-butylsulfanyl-butan-1-one CAS Name: 1-(4-bromophenyl)-4-(tert-butylthio)-1-butanone IUPAC Name: 1-(4-bromophenyl)-4-tert-butylsulfanylbutan-1-one Traditional Name: 1-(4-bromophenyl)-4-(tert-butylthio)butan-1-one Formula: C14H19BrOS MolecularWeight: 315.26906

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)SCCCC(=O)C1=CC=C(C=C1)Br

Isomeric SMILES

CC(C)(C)SCCCC(=O)C1=CC=C(C=C1)Br

InChI

InChI=1S/C14H19BrOS/c1-14(2,3)17-10-4-5-13(16)11-6-8-12(15)9-7-11/h6-9H,4-5,10H2,1-3H3