dilithium 3-[(3-oxidanidyl-3-oxidanylidene-propyl)sulfanyl-[3-(quinolin-2-ylcarbonylamino)phenyl]methyl]sulfanylpropanoate

Systemtic Name: dilithium 3-[(3-oxidanidyl-3-oxidanylidene-propyl)sulfanyl-[3-(quinolin-2-ylcarbonylamino)phenyl]methyl]sulfanylpropanoate Openeye Name: dilithium 3-[(3-oxido-3-oxo-propyl)sulfanyl-[3-(quinoline-2-carbonylamino)phenyl]methyl]sulfanylpropanoate CAS Name: dilithium 3-[[[(3-oxido-3-oxopropyl)thio]-[3-[[oxo(2-quinolinyl)methyl]amino]phenyl]methyl]thio]propanoate IUPAC Name: dilithium 3-[(3-oxido-3-oxopropyl)sulfanyl-[3-(quinoline-2-carbonylamino)phenyl]methyl]sulfanylpropanoate Traditional Name: dilithium 3-[[[(3-keto-3-oxido-propyl)thio]-[3-(quinaldoylamino)phenyl]methyl]thio]propionate Formula: C23H20Li2N2O5S2 MolecularWeight: 482.4273

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Descriptors Computed from Structure

Canonical SMILES:

[Li+].[Li+].C1=CC=C2C(=C1)C=CC(=N2)C(=O)NC3=CC=CC(=C3)C(SCCC(=O)[O-])SCCC(=O)[O-]

Isomeric SMILES

[Li+].[Li+].C1=CC=C2C(=C1)C=CC(=N2)C(=O)NC3=CC=CC(=C3)C(SCCC(=O)[O-])SCCC(=O)[O-]

InChI

InChI=1S/C23H22N2O5S2.2Li/c26-20(27)10-12-31-23(32-13-11-21(28)29)16-5-3-6-17(14-16)24-22(30)19-9-8-15-4-1-2-7-18(15)25-19;;/h1-9,14,23H,10-13H2,(H,24,30)(H,26,27)(H,28,29);;/q;2*+1/p-2