4-[[4-chloranyl-1-(3-nitrophenyl)-2,5-bis(oxidanylidene)pyrrol-3-yl]amino]-N-pyrimidin-2-yl-benzenesulfonamide

Systemtic Name: 4-[[4-chloranyl-1-(3-nitrophenyl)-2,5-bis(oxidanylidene)pyrrol-3-yl]amino]-N-pyrimidin-2-yl-benzenesulfonamide Openeye Name: 4-[[4-chloro-1-(3-nitrophenyl)-2,5-dioxo-pyrrol-3-yl]amino]-N-pyrimidin-2-yl-benzenesulfonamide CAS Name: 4-[[4-chloro-1-(3-nitrophenyl)-2,5-dioxo-3-pyrrolyl]amino]-N-(2-pyrimidinyl)benzenesulfonamide IUPAC Name: 4-[[4-chloro-1-(3-nitrophenyl)-2,5-dioxopyrrol-3-yl]amino]-N-pyrimidin-2-ylbenzenesulfonamide Traditional Name: 4-[[4-chloro-2,5-diketo-1-(3-nitrophenyl)-3-pyrrolin-3-yl]amino]-N-(2-pyrimidyl)benzenesulfonamide Formula: C20H13ClN6O6S MolecularWeight: 500.87182

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])N2C(=O)C(=C(C2=O)Cl)NC3=CC=C(C=C3)S(=O)(=O)NC4=NC=CC=N4

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])N2C(=O)C(=C(C2=O)Cl)NC3=CC=C(C=C3)S(=O)(=O)NC4=NC=CC=N4

InChI

InChI=1S/C20H13ClN6O6S/c21-16-17(19(29)26(18(16)28)13-3-1-4-14(11-13)27(30)31)24-12-5-7-15(8-6-12)34(32,33)25-20-22-9-2-10-23-20/h1-11,24H,(H,22,23,25)