1-(1-methylpiperazin-2-yl)-6,8-bis(sulfanyl)octan-1-one

Systemtic Name: 1-(1-methylpiperazin-2-yl)-6,8-bis(sulfanyl)octan-1-one Openeye Name: 1-(1-methylpiperazin-2-yl)-6,8-bis(sulfanyl)octan-1-one CAS Name: 6,8-dimercapto-1-(1-methyl-2-piperazinyl)-1-octanone IUPAC Name: 1-(1-methylpiperazin-2-yl)-6,8-bis(sulfanyl)octan-1-one Traditional Name: 6,8-dimercapto-1-(1-methylpiperazin-2-yl)octan-1-one Formula: C13H26N2OS2 MolecularWeight: 290.48834

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCNCC1C(=O)CCCCC(CCS)S

Isomeric SMILES

CN1CCNCC1C(=O)CCCCC(CCS)S

InChI

InChI=1S/C13H26N2OS2/c1-15-8-7-14-10-12(15)13(16)5-3-2-4-11(18)6-9-17/h11-12,14,17-18H,2-10H2,1H3