5-[[4-(6-methylpyridin-2-yl)sulfanyl-1-oxidanyl-naphthalen-2-yl]carbonylamino]benzene-1,3-dicarboxylic acid

Systemtic Name: 5-[[4-(6-methylpyridin-2-yl)sulfanyl-1-oxidanyl-naphthalen-2-yl]carbonylamino]benzene-1,3-dicarboxylic acid Openeye Name: 5-[[1-hydroxy-4-[(6-methyl-2-pyridyl)sulfanyl]naphthalene-2-carbonyl]amino]benzene-1,3-dicarboxylic acid CAS Name: 5-[[[1-hydroxy-4-[(6-methyl-2-pyridinyl)thio]-2-naphthalenyl]-oxomethyl]amino]benzene-1,3-dicarboxylic acid IUPAC Name: 5-[[1-hydroxy-4-(6-methylpyridin-2-yl)sulfanylnaphthalene-2-carbonyl]amino]benzene-1,3-dicarboxylic acid Traditional Name: 5-[[1-hydroxy-4-[(6-methyl-2-pyridyl)thio]-2-naphthoyl]amino]isophthalic acid Formula: C25H18N2O6S MolecularWeight: 474.48522

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC=C1)SC2=CC(=C(C3=CC=CC=C32)O)C(=O)NC4=CC(=CC(=C4)C(=O)O)C(=O)O

Isomeric SMILES

CC1=NC(=CC=C1)SC2=CC(=C(C3=CC=CC=C32)O)C(=O)NC4=CC(=CC(=C4)C(=O)O)C(=O)O

InChI

InChI=1S/C25H18N2O6S/c1-13-5-4-8-21(26-13)34-20-12-19(22(28)18-7-3-2-6-17(18)20)23(29)27-16-10-14(24(30)31)9-15(11-16)25(32)33/h2-12,28H,1H3,(H,27,29)(H,30,31)(H,32,33)