methyl (2S)-2-[4-but-3-enyl-2,5-bis(oxidanylidene)imidazolidin-1-yl]-4-methylsulfanyl-butanoate

Systemtic Name: methyl (2S)-2-[4-but-3-enyl-2,5-bis(oxidanylidene)imidazolidin-1-yl]-4-methylsulfanyl-butanoate Openeye Name: methyl (2S)-2-(4-but-3-enyl-2,5-dioxo-imidazolidin-1-yl)-4-methylsulfanyl-butanoate CAS Name: (2S)-2-(4-but-3-enyl-2,5-dioxo-1-imidazolidinyl)-4-(methylthio)butanoic acid methyl ester IUPAC Name: methyl (2S)-2-(4-but-3-enyl-2,5-dioxoimidazolidin-1-yl)-4-methylsulfanylbutanoate Traditional Name: (2S)-2-(4-but-3-enyl-2,5-diketo-imidazolidin-1-yl)-4-(methylthio)butyric acid methyl ester Formula: C13H20N2O4S MolecularWeight: 300.3739

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CCSC)N1C(=O)C(NC1=O)CCC=C

Isomeric SMILES

COC(=O)[C@H](CCSC)N1C(=O)C(NC1=O)CCC=C

InChI

InChI=1S/C13H20N2O4S/c1-4-5-6-9-11(16)15(13(18)14-9)10(7-8-20-3)12(17)19-2/h4,9-10H,1,5-8H2,2-3H3,(H,14,18)/t9?,10-/m0/s1