2,8-bis(4-methylsulfanylphenyl)pyrido[3,2-g]quinoline-4,6-dicarboxylic acid

Systemtic Name: 2,8-bis(4-methylsulfanylphenyl)pyrido[3,2-g]quinoline-4,6-dicarboxylic acid Openeye Name: 2,8-bis(4-methylsulfanylphenyl)pyrido[3,2-g]quinoline-4,6-dicarboxylic acid CAS Name: 2,8-bis[4-(methylthio)phenyl]pyrido[3,2-g]quinoline-4,6-dicarboxylic acid IUPAC Name: 2,8-bis(4-methylsulfanylphenyl)pyrido[3,2-g]quinoline-4,6-dicarboxylic acid Traditional Name: 2,8-bis[4-(methylthio)phenyl]pyrido[3,2-g]quinoline-4,6-dicarboxylic acid Formula: C28H20N2O4S2 MolecularWeight: 512.5994

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C2=NC3=CC4=C(C=C3C(=C2)C(=O)O)C(=CC(=N4)C5=CC=C(C=C5)SC)C(=O)O

Isomeric SMILES

CSC1=CC=C(C=C1)C2=NC3=CC4=C(C=C3C(=C2)C(=O)O)C(=CC(=N4)C5=CC=C(C=C5)SC)C(=O)O

InChI

InChI=1S/C28H20N2O4S2/c1-35-17-7-3-15(4-8-17)23-12-21(27(31)32)19-11-20-22(28(33)34)13-24(30-26(20)14-25(19)29-23)16-5-9-18(36-2)10-6-16/h3-14H,1-2H3,(H,31,32)(H,33,34)