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

Systemtic Name: 3-azanyl-4-[[1-[2-[(4-methylsulfanyl-1-oxidanyl-1-oxidanylidene-butan-2-yl)carbamoyl]pyrrolidin-1-yl]-1-oxidanylidene-propan-2-yl]amino]-4-oxidanylidene-butanoic acid Openeye Name: 3-amino-4-[[2-[2-[(1-carboxy-3-methylsulfanyl-propyl)carbamoyl]pyrrolidin-1-yl]-1-methyl-2-oxo-ethyl]amino]-4-oxo-butanoic acid CAS Name: 3-amino-4-[[1-[2-[[[1-hydroxy-4-(methylthio)-1-oxobutan-2-yl]amino]-oxomethyl]-1-pyrrolidinyl]-1-oxopropan-2-yl]amino]-4-oxobutanoic acid IUPAC Name: 3-amino-4-[[1-[2-[(1-hydroxy-4-methylsulfanyl-1-oxobutan-2-yl)carbamoyl]pyrrolidin-1-yl]-1-oxopropan-2-yl]amino]-4-oxobutanoic acid Traditional Name: 3-amino-4-[[2-[2-[[1-carboxy-3-(methylthio)propyl]carbamoyl]pyrrolidino]-2-keto-1-methyl-ethyl]amino]-4-keto-butyric acid Formula: C17H28N4O7S MolecularWeight: 432.49182

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCCC1C(=O)NC(CCSC)C(=O)O)NC(=O)C(CC(=O)O)N

Isomeric SMILES

CC(C(=O)N1CCCC1C(=O)NC(CCSC)C(=O)O)NC(=O)C(CC(=O)O)N

InChI

InChI=1S/C17H28N4O7S/c1-9(19-14(24)10(18)8-13(22)23)16(26)21-6-3-4-12(21)15(25)20-11(17(27)28)5-7-29-2/h9-12H,3-8,18H2,1-2H3,(H,19,24)(H,20,25)(H,22,23)(H,27,28)