3-[[3-[(E)-2-(7-chloranylquinolin-2-yl)ethenyl]phenyl]-(3-oxidanidyl-3-oxidanylidene-propyl)sulfanyl-methyl]sulfanylpropanoate

Systemtic Name: 3-[[3-[(E)-2-(7-chloranylquinolin-2-yl)ethenyl]phenyl]-(3-oxidanidyl-3-oxidanylidene-propyl)sulfanyl-methyl]sulfanylpropanoate Openeye Name: 3-[[3-[(E)-2-(7-chloro-2-quinolyl)vinyl]phenyl]-(3-oxido-3-oxo-propyl)sulfanyl-methyl]sulfanylpropanoate CAS Name: 3-[[[3-[(E)-2-(7-chloro-2-quinolinyl)ethenyl]phenyl]-[(3-oxido-3-oxopropyl)thio]methyl]thio]propanoate IUPAC Name: 3-[[3-[(E)-2-(7-chloroquinolin-2-yl)ethenyl]phenyl]-(3-oxido-3-oxopropyl)sulfanylmethyl]sulfanylpropanoate Traditional Name: 3-[[[3-[(E)-2-(7-chloro-2-quinolyl)vinyl]phenyl]-[(3-keto-3-oxido-propyl)thio]methyl]thio]propionate Formula: C24H20ClNO4S2-2 MolecularWeight: 486.0029

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C(SCCC(=O)[O-])SCCC(=O)[O-])C=CC2=NC3=C(C=CC(=C3)Cl)C=C2

Isomeric SMILES

C1=CC(=CC(=C1)C(SCCC(=O)[O-])SCCC(=O)[O-])/C=C/C2=NC3=C(C=CC(=C3)Cl)C=C2

InChI

InChI=1S/C24H22ClNO4S2/c25-19-7-5-17-6-9-20(26-21(17)15-19)8-4-16-2-1-3-18(14-16)24(31-12-10-22(27)28)32-13-11-23(29)30/h1-9,14-15,24H,10-13H2,(H,27,28)(H,29,30)/p-2/b8-4+