7-[[7-(pyrimidin-2-ylsulfamoyl)naphthalen-2-yl]carbamoylamino]naphthalene-2-sulfonic acid

Systemtic Name: 7-[[7-(pyrimidin-2-ylsulfamoyl)naphthalen-2-yl]carbamoylamino]naphthalene-2-sulfonic acid Openeye Name: 7-[[7-(pyrimidin-2-ylsulfamoyl)-2-naphthyl]carbamoylamino]naphthalene-2-sulfonic acid CAS Name: 7-[[oxo-[[7-(2-pyrimidinylsulfamoyl)-2-naphthalenyl]amino]methyl]amino]-2-naphthalenesulfonic acid IUPAC Name: 7-[[7-(pyrimidin-2-ylsulfamoyl)naphthalen-2-yl]carbamoylamino]naphthalene-2-sulfonic acid Traditional Name: 7-[[7-(2-pyrimidylsulfamoyl)-2-naphthyl]carbamoylamino]naphthalene-2-sulfonic acid Formula: C25H19N5O6S2 MolecularWeight: 549.57826

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=C(N=C1)NS(=O)(=O)C2=CC3=C(C=CC(=C3)NC(=O)NC4=CC5=C(C=C4)C=CC(=C5)S(=O)(=O)O)C=C2

Isomeric SMILES

C1=CN=C(N=C1)NS(=O)(=O)C2=CC3=C(C=CC(=C3)NC(=O)NC4=CC5=C(C=C4)C=CC(=C5)S(=O)(=O)O)C=C2

InChI

InChI=1S/C25H19N5O6S2/c31-25(29-21-7-3-17-5-9-23(38(34,35)36)15-19(17)13-21)28-20-6-2-16-4-8-22(14-18(16)12-20)37(32,33)30-24-26-10-1-11-27-24/h1-15H,(H,26,27,30)(H2,28,29,31)(H,34,35,36)