methyl (6S)-6,8-bis(carbamimidoylsulfanyl)octanoate

Systemtic Name: methyl (6S)-6,8-bis(carbamimidoylsulfanyl)octanoate Openeye Name: methyl (6S)-6,8-bis(carbamimidoylsulfanyl)octanoate CAS Name: (6S)-6,8-bis(carbamimidoylthio)octanoic acid methyl ester IUPAC Name: methyl (6S)-6,8-bis(carbamimidoylsulfanyl)octanoate Traditional Name: (6S)-6,8-bis(amidinothio)caprylic acid methyl ester Formula: C11H22N4O2S2 MolecularWeight: 306.44798

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCCC(CCSC(=N)N)SC(=N)N

Isomeric SMILES

COC(=O)CCCC[C@@H](CCSC(=N)N)SC(=N)N

InChI

InChI=1S/C11H22N4O2S2/c1-17-9(16)5-3-2-4-8(19-11(14)15)6-7-18-10(12)13/h8H,2-7H2,1H3,(H3,12,13)(H3,14,15)/t8-/m0/s1