1-[4-(4-bromophenyl)sulfonylpiperazin-1-yl]-5-(1,2-dithiolan-3-yl)pentan-1-one

Systemtic Name: 1-[4-(4-bromophenyl)sulfonylpiperazin-1-yl]-5-(1,2-dithiolan-3-yl)pentan-1-one Openeye Name: 1-[4-(4-bromophenyl)sulfonylpiperazin-1-yl]-5-(dithiolan-3-yl)pentan-1-one CAS Name: 1-[4-(4-bromophenyl)sulfonyl-1-piperazinyl]-5-(3-dithiolanyl)-1-pentanone IUPAC Name: 1-[4-(4-bromophenyl)sulfonylpiperazin-1-yl]-5-(dithiolan-3-yl)pentan-1-one Traditional Name: 1-(4-brosylpiperazino)-5-(dithiolan-3-yl)pentan-1-one Formula: C18H25BrN2O3S3 MolecularWeight: 493.5017

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Descriptors Computed from Structure

Canonical SMILES:

C1CSSC1CCCCC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

C1CSSC1CCCCC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C18H25BrN2O3S3/c19-15-5-7-17(8-6-15)27(23,24)21-12-10-20(11-13-21)18(22)4-2-1-3-16-9-14-25-26-16/h5-8,16H,1-4,9-14H2