(2S)-2-[[2-[bis(prop-2-enyl)azaniumyl]-2-methyl-propanoyl]amino]-4-methylsulfanyl-butanoate

Systemtic Name: (2S)-2-[[2-[bis(prop-2-enyl)azaniumyl]-2-methyl-propanoyl]amino]-4-methylsulfanyl-butanoate Openeye Name: (2S)-2-[[2-(diallylammonio)-2-methyl-propanoyl]amino]-4-methylsulfanyl-butanoate CAS Name: (2S)-2-[[2-[bis(prop-2-enyl)ammonio]-2-methyl-1-oxopropyl]amino]-4-(methylthio)butanoate IUPAC Name: (2S)-2-[[2-[bis(prop-2-enyl)azaniumyl]-2-methylpropanoyl]amino]-4-methylsulfanylbutanoate Traditional Name: (2S)-2-[[2-(diallylammonio)-2-methyl-propanoyl]amino]-4-(methylthio)butyrate Formula: C15H26N2O3S MolecularWeight: 314.44354

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)NC(CCSC)C(=O)[O-])[NH+](CC=C)CC=C

Isomeric SMILES

CC(C)(C(=O)N[C@@H](CCSC)C(=O)[O-])[NH+](CC=C)CC=C

InChI

InChI=1S/C15H26N2O3S/c1-6-9-17(10-7-2)15(3,4)14(20)16-12(13(18)19)8-11-21-5/h6-7,12H,1-2,8-11H2,3-5H3,(H,16,20)(H,18,19)/t12-/m0/s1