1-[4-(3-bromophenyl)sulfonylpiperazin-1-yl]-4-phenylsulfanyl-butan-1-one

Systemtic Name: 1-[4-(3-bromophenyl)sulfonylpiperazin-1-yl]-4-phenylsulfanyl-butan-1-one Openeye Name: 1-[4-(3-bromophenyl)sulfonylpiperazin-1-yl]-4-phenylsulfanyl-butan-1-one CAS Name: 1-[4-(3-bromophenyl)sulfonyl-1-piperazinyl]-4-(phenylthio)-1-butanone IUPAC Name: 1-[4-(3-bromophenyl)sulfonylpiperazin-1-yl]-4-phenylsulfanylbutan-1-one Traditional Name: 1-[4-(3-bromophenyl)sulfonylpiperazino]-4-(phenylthio)butan-1-one Formula: C20H23BrN2O3S2 MolecularWeight: 483.44222

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CCCSC2=CC=CC=C2)S(=O)(=O)C3=CC(=CC=C3)Br

Isomeric SMILES

C1CN(CCN1C(=O)CCCSC2=CC=CC=C2)S(=O)(=O)C3=CC(=CC=C3)Br

InChI

InChI=1S/C20H23BrN2O3S2/c21-17-6-4-9-19(16-17)28(25,26)23-13-11-22(12-14-23)20(24)10-5-15-27-18-7-2-1-3-8-18/h1-4,6-9,16H,5,10-15H2