5-[(4-methylsulfanyl-1-oxidanyl-1-oxidanylidene-butan-2-yl)amino]-5-oxidanylidene-2-[(4-phenylphenyl)sulfonylamino]pentanoic acid

Systemtic Name: 5-[(4-methylsulfanyl-1-oxidanyl-1-oxidanylidene-butan-2-yl)amino]-5-oxidanylidene-2-[(4-phenylphenyl)sulfonylamino]pentanoic acid Openeye Name: 5-[(1-carboxy-3-methylsulfanyl-propyl)amino]-5-oxo-2-[(4-phenylphenyl)sulfonylamino]pentanoic acid CAS Name: 5-[[1-hydroxy-4-(methylthio)-1-oxobutan-2-yl]amino]-5-oxo-2-[(4-phenylphenyl)sulfonylamino]pentanoic acid IUPAC Name: 5-[(1-hydroxy-4-methylsulfanyl-1-oxobutan-2-yl)amino]-5-oxo-2-[(4-phenylphenyl)sulfonylamino]pentanoic acid Traditional Name: 5-[[1-carboxy-3-(methylthio)propyl]amino]-5-keto-2-[(4-phenylphenyl)sulfonylamino]valeric acid Formula: C22H26N2O7S2 MolecularWeight: 494.58104

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)O)NC(=O)CCC(C(=O)O)NS(=O)(=O)C1=CC=C(C=C1)C2=CC=CC=C2

Isomeric SMILES

CSCCC(C(=O)O)NC(=O)CCC(C(=O)O)NS(=O)(=O)C1=CC=C(C=C1)C2=CC=CC=C2

InChI

InChI=1S/C22H26N2O7S2/c1-32-14-13-18(21(26)27)23-20(25)12-11-19(22(28)29)24-33(30,31)17-9-7-16(8-10-17)15-5-3-2-4-6-15/h2-10,18-19,24H,11-14H2,1H3,(H,23,25)(H,26,27)(H,28,29)