methyl (2S)-2-[4-[(2S)-1-methoxy-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]piperazin-1-yl]-4-methylsulfanyl-butanoate

Systemtic Name: methyl (2S)-2-[4-[(2S)-1-methoxy-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]piperazin-1-yl]-4-methylsulfanyl-butanoate Openeye Name: methyl (2S)-2-[4-[(1S)-1-methoxycarbonyl-3-methylsulfanyl-propyl]piperazin-1-yl]-4-methylsulfanyl-butanoate CAS Name: (2S)-2-[4-[(2S)-1-methoxy-4-(methylthio)-1-oxobutan-2-yl]-1-piperazinyl]-4-(methylthio)butanoic acid methyl ester IUPAC Name: methyl (2S)-2-[4-[(2S)-1-methoxy-4-methylsulfanyl-1-oxobutan-2-yl]piperazin-1-yl]-4-methylsulfanylbutanoate Traditional Name: (2S)-2-[4-[(1S)-1-carbomethoxy-3-(methylthio)propyl]piperazino]-4-(methylthio)butyric acid methyl ester Formula: C16H30N2O4S2 MolecularWeight: 378.5504

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CCSC)N1CCN(CC1)C(CCSC)C(=O)OC

Isomeric SMILES

COC(=O)[C@H](CCSC)N1CCN(CC1)[C@@H](CCSC)C(=O)OC

InChI

InChI=1S/C16H30N2O4S2/c1-21-15(19)13(5-11-23-3)17-7-9-18(10-8-17)14(6-12-24-4)16(20)22-2/h13-14H,5-12H2,1-4H3/t13-,14-/m0/s1