3,7-bis(ethylsulfanyl)-2,8-diphenyl-pyrido[3,2-g]quinoline-4,6-dicarboxylic acid

Systemtic Name: 3,7-bis(ethylsulfanyl)-2,8-diphenyl-pyrido[3,2-g]quinoline-4,6-dicarboxylic acid Openeye Name: 3,7-bis(ethylsulfanyl)-2,8-diphenyl-pyrido[3,2-g]quinoline-4,6-dicarboxylic acid CAS Name: 3,7-bis(ethylthio)-2,8-diphenylpyrido[3,2-g]quinoline-4,6-dicarboxylic acid IUPAC Name: 3,7-bis(ethylsulfanyl)-2,8-diphenylpyrido[3,2-g]quinoline-4,6-dicarboxylic acid Traditional Name: 3,7-bis(ethylthio)-2,8-diphenyl-pyrido[3,2-g]quinoline-4,6-dicarboxylic acid Formula: C30H24N2O4S2 MolecularWeight: 540.65256

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=C(C2=CC3=C(C(=C(N=C3C=C2N=C1C4=CC=CC=C4)C5=CC=CC=C5)SCC)C(=O)O)C(=O)O

Isomeric SMILES

CCSC1=C(C2=CC3=C(C(=C(N=C3C=C2N=C1C4=CC=CC=C4)C5=CC=CC=C5)SCC)C(=O)O)C(=O)O

InChI

InChI=1S/C30H24N2O4S2/c1-3-37-27-23(29(33)34)19-15-20-22(16-21(19)31-25(27)17-11-7-5-8-12-17)32-26(18-13-9-6-10-14-18)28(38-4-2)24(20)30(35)36/h5-16H,3-4H2,1-2H3,(H,33,34)(H,35,36)