(2R)-2-[[2-[[(2S)-butan-2-yl]amino]-2-oxidanylidene-ethyl]carbamoylamino]-4-methylsulfanyl-butanoate

Systemtic Name: (2R)-2-[[2-[[(2S)-butan-2-yl]amino]-2-oxidanylidene-ethyl]carbamoylamino]-4-methylsulfanyl-butanoate Openeye Name: (2R)-2-[[2-[[(1S)-1-methylpropyl]amino]-2-oxo-ethyl]carbamoylamino]-4-methylsulfanyl-butanoate CAS Name: (2R)-2-[[[[2-[[(2S)-butan-2-yl]amino]-2-oxoethyl]amino]-oxomethyl]amino]-4-(methylthio)butanoate IUPAC Name: (2R)-2-[[2-[[(2S)-butan-2-yl]amino]-2-oxoethyl]carbamoylamino]-4-methylsulfanylbutanoate Traditional Name: (2R)-2-[[2-keto-2-[[(1S)-1-methylpropyl]amino]ethyl]carbamoylamino]-4-(methylthio)butyrate Formula: C12H22N3O4S- MolecularWeight: 304.38578

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)CNC(=O)NC(CCSC)C(=O)[O-]

Isomeric SMILES

CC[C@H](C)NC(=O)CNC(=O)N[C@H](CCSC)C(=O)[O-]

InChI

InChI=1S/C12H23N3O4S/c1-4-8(2)14-10(16)7-13-12(19)15-9(11(17)18)5-6-20-3/h8-9H,4-7H2,1-3H3,(H,14,16)(H,17,18)(H2,13,15,19)/p-1/t8-,9+/m0/s1