disodium 5-[[3-[5-acetamido-4-(5-acetamido-2-oxidanyl-phenyl)-2-oxidanyl-phenyl]sulfanyl-1-[(2-oxidanidyl-2-oxidanylidene-ethyl)amino]-1-oxidanylidene-propan-2-yl]amino]-2-azanyl-5-oxidanylidene-pentanoate

Systemtic Name: disodium 5-[[3-[5-acetamido-4-(5-acetamido-2-oxidanyl-phenyl)-2-oxidanyl-phenyl]sulfanyl-1-[(2-oxidanidyl-2-oxidanylidene-ethyl)amino]-1-oxidanylidene-propan-2-yl]amino]-2-azanyl-5-oxidanylidene-pentanoate Openeye Name: disodium 5-[[1-[[5-acetamido-4-(5-acetamido-2-hydroxy-phenyl)-2-hydroxy-phenyl]sulfanylmethyl]-2-[(2-oxido-2-oxo-ethyl)amino]-2-oxo-ethyl]amino]-2-amino-5-oxo-pentanoate CAS Name: disodium 5-[[3-[[5-acetamido-4-(5-acetamido-2-hydroxyphenyl)-2-hydroxyphenyl]thio]-1-[(2-oxido-2-oxoethyl)amino]-1-oxopropan-2-yl]amino]-2-amino-5-oxopentanoate IUPAC Name: disodium 5-[[3-[5-acetamido-4-(5-acetamido-2-hydroxyphenyl)-2-hydroxyphenyl]sulfanyl-1-[(2-oxido-2-oxoethyl)amino]-1-oxopropan-2-yl]amino]-2-amino-5-oxopentanoate Traditional Name: disodium 5-[[1-[[[5-acetamido-4-(5-acetamido-2-hydroxy-phenyl)-2-hydroxy-phenyl]thio]methyl]-2-keto-2-[(2-keto-2-oxido-ethyl)amino]ethyl]amino]-2-amino-5-keto-valerate Formula: C26H29N5Na2O10S MolecularWeight: 649.5805

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=C(C=C1)O)C2=CC(=C(C=C2NC(=O)C)SCC(C(=O)NCC(=O)[O-])NC(=O)CCC(C(=O)[O-])N)O.[Na+].[Na+]

Isomeric SMILES

CC(=O)NC1=CC(=C(C=C1)O)C2=CC(=C(C=C2NC(=O)C)SCC(C(=O)NCC(=O)[O-])NC(=O)CCC(C(=O)[O-])N)O.[Na+].[Na+]

InChI

InChI=1S/C26H31N5O10S.2Na/c1-12(32)29-14-3-5-20(34)16(7-14)15-8-21(35)22(9-18(15)30-13(2)33)42-11-19(25(39)28-10-24(37)38)31-23(36)6-4-17(27)26(40)41;;/h3,5,7-9,17,19,34-35H,4,6,10-11,27H2,1-2H3,(H,28,39)(H,29,32)(H,30,33)(H,31,36)(H,37,38)(H,40,41);;/q;2*+1/p-2