sodium 4-[[3-chloranyl-1,4-bis(oxidanylidene)naphthalen-2-yl]amino]-N-pyrimidin-2-yl-benzenesulfonamide

Systemtic Name: sodium 4-[[3-chloranyl-1,4-bis(oxidanylidene)naphthalen-2-yl]amino]-N-pyrimidin-2-yl-benzenesulfonamide Openeye Name: sodium 4-[(3-chloro-1,4-dioxo-2-naphthyl)amino]-N-pyrimidin-2-yl-benzenesulfonamide CAS Name: sodium 4-[(3-chloro-1,4-dioxo-2-naphthalenyl)amino]-N-(2-pyrimidinyl)benzenesulfonamide IUPAC Name: sodium 4-[(3-chloro-1,4-dioxonaphthalen-2-yl)amino]-N-pyrimidin-2-ylbenzenesulfonamide Traditional Name: sodium 4-[(3-chloro-1,4-diketo-2-naphthyl)amino]-N-(2-pyrimidyl)benzenesulfonamide Formula: C20H13ClN4NaO4S+ MolecularWeight: 463.84939

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)C(=C(C2=O)Cl)NC3=CC=C(C=C3)S(=O)(=O)NC4=NC=CC=N4.[Na+]

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)C(=C(C2=O)Cl)NC3=CC=C(C=C3)S(=O)(=O)NC4=NC=CC=N4.[Na+]

InChI

InChI=1S/C20H13ClN4O4S.Na/c21-16-17(19(27)15-5-2-1-4-14(15)18(16)26)24-12-6-8-13(9-7-12)30(28,29)25-20-22-10-3-11-23-20;/h1-11,24H,(H,22,23,25);/q;+1