3-azanyl-4-[[3-methyl-1-[[4-methylsulfanyl-1-oxidanylidene-1-[(1-oxidanyl-1-oxidanylidene-3-sulfanyl-propan-2-yl)amino]butan-2-yl]amino]-1-oxidanylidene-butan-2-yl]amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 3-azanyl-4-[[3-methyl-1-[[4-methylsulfanyl-1-oxidanylidene-1-[(1-oxidanyl-1-oxidanylidene-3-sulfanyl-propan-2-yl)amino]butan-2-yl]amino]-1-oxidanylidene-butan-2-yl]amino]-4-oxidanylidene-butanoic acid Openeye Name: 3-amino-4-[[1-[[1-[[2-hydroxy-2-oxo-1-(sulfanylmethyl)ethyl]carbamoyl]-3-methylsulfanyl-propyl]carbamoyl]-2-methyl-propyl]amino]-4-oxo-butanoic acid CAS Name: 3-amino-4-[[1-[[1-[(1-hydroxy-3-mercapto-1-oxopropan-2-yl)amino]-4-(methylthio)-1-oxobutan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]amino]-4-oxobutanoic acid IUPAC Name: 3-amino-4-[[1-[[1-[(1-hydroxy-1-oxo-3-sulfanylpropan-2-yl)amino]-4-methylsulfanyl-1-oxobutan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]amino]-4-oxobutanoic acid Traditional Name: 3-amino-4-[[1-[[1-[[2-hydroxy-2-keto-1-(mercaptomethyl)ethyl]carbamoyl]-3-(methylthio)propyl]carbamoyl]-2-methyl-propyl]amino]-4-keto-butyric acid Formula: C17H30N4O7S2 MolecularWeight: 466.5727

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H30N4O7S2/c1-8(2)13(21-14(24)9(18)6-12(22)23)16(26)19-10(4-5-30-3)15(25)20-11(7-29)17(27)28/h8-11,13,29H,4-7,18H2,1-3H3,(H,19,26)(H,20,25)(H,21,24)(H,22,23)(H,27,28)