2-azanyl-5-[[4-azanyl-1-[4-ethoxy-1-oxidanyl-1,4-bis(oxidanylidene)butan-2-yl]sulfanyl-3-oxidanylidene-butan-2-yl]amino]-5-oxidanylidene-pentanoic acid

Systemtic Name: 2-azanyl-5-[[4-azanyl-1-[4-ethoxy-1-oxidanyl-1,4-bis(oxidanylidene)butan-2-yl]sulfanyl-3-oxidanylidene-butan-2-yl]amino]-5-oxidanylidene-pentanoic acid Openeye Name: 2-amino-5-[[3-amino-1-[(1-carboxy-3-ethoxy-3-oxo-propyl)sulfanylmethyl]-2-oxo-propyl]amino]-5-oxo-pentanoic acid CAS Name: 2-amino-5-[[4-amino-1-[(4-ethoxy-1-hydroxy-1,4-dioxobutan-2-yl)thio]-3-oxobutan-2-yl]amino]-5-oxopentanoic acid IUPAC Name: 2-amino-5-[[4-amino-1-(4-ethoxy-1-hydroxy-1,4-dioxobutan-2-yl)sulfanyl-3-oxobutan-2-yl]amino]-5-oxopentanoic acid Traditional Name: 2-amino-5-[[3-amino-1-[[(1-carboxy-3-ethoxy-3-keto-propyl)thio]methyl]-2-keto-propyl]amino]-5-keto-valeric acid Formula: C15H25N3O8S MolecularWeight: 407.4393

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(C(=O)O)SCC(C(=O)CN)NC(=O)CCC(C(=O)O)N

Isomeric SMILES

CCOC(=O)CC(C(=O)O)SCC(C(=O)CN)NC(=O)CCC(C(=O)O)N

InChI

InChI=1S/C15H25N3O8S/c1-2-26-13(21)5-11(15(24)25)27-7-9(10(19)6-16)18-12(20)4-3-8(17)14(22)23/h8-9,11H,2-7,16-17H2,1H3,(H,18,20)(H,22,23)(H,24,25)