3-[2-(2-azanylpropanoylamino)propanoylamino]-4-[(4-methylsulfanyl-1-oxidanyl-1-oxidanylidene-butan-2-yl)amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 3-[2-(2-azanylpropanoylamino)propanoylamino]-4-[(4-methylsulfanyl-1-oxidanyl-1-oxidanylidene-butan-2-yl)amino]-4-oxidanylidene-butanoic acid Openeye Name: 3-[2-(2-aminopropanoylamino)propanoylamino]-4-[(1-carboxy-3-methylsulfanyl-propyl)amino]-4-oxo-butanoic acid CAS Name: 3-[[2-[(2-amino-1-oxopropyl)amino]-1-oxopropyl]amino]-4-[[1-hydroxy-4-(methylthio)-1-oxobutan-2-yl]amino]-4-oxobutanoic acid IUPAC Name: 3-[2-(2-aminopropanoylamino)propanoylamino]-4-[(1-hydroxy-4-methylsulfanyl-1-oxobutan-2-yl)amino]-4-oxobutanoic acid Traditional Name: 3-[2-(alanylamino)propanoylamino]-4-[[1-carboxy-3-(methylthio)propyl]amino]-4-keto-butyric acid Formula: C15H26N4O7S MolecularWeight: 406.45454

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(C)C(=O)NC(CC(=O)O)C(=O)NC(CCSC)C(=O)O)N

Isomeric SMILES

CC(C(=O)NC(C)C(=O)NC(CC(=O)O)C(=O)NC(CCSC)C(=O)O)N

InChI

InChI=1S/C15H26N4O7S/c1-7(16)12(22)17-8(2)13(23)19-10(6-11(20)21)14(24)18-9(15(25)26)4-5-27-3/h7-10H,4-6,16H2,1-3H3,(H,17,22)(H,18,24)(H,19,23)(H,20,21)(H,25,26)