4-[(4Z)-4-[[5-(4-chloranyl-3-nitro-phenyl)furan-2-yl]methylidene]-3-methyl-5-oxidanylidene-pyrazol-1-yl]benzenesulfonamide

Systemtic Name: 4-[(4Z)-4-[[5-(4-chloranyl-3-nitro-phenyl)furan-2-yl]methylidene]-3-methyl-5-oxidanylidene-pyrazol-1-yl]benzenesulfonamide Openeye Name: 4-[(4Z)-4-[[5-(4-chloro-3-nitro-phenyl)-2-furyl]methylene]-3-methyl-5-oxo-pyrazol-1-yl]benzenesulfonamide CAS Name: 4-[(4Z)-4-[[5-(4-chloro-3-nitrophenyl)-2-furanyl]methylidene]-3-methyl-5-oxo-1-pyrazolyl]benzenesulfonamide IUPAC Name: 4-[(4Z)-4-[[5-(4-chloro-3-nitrophenyl)furan-2-yl]methylidene]-3-methyl-5-oxopyrazol-1-yl]benzenesulfonamide Traditional Name: 4-[(4Z)-4-[[5-(4-chloro-3-nitro-phenyl)-2-furyl]methylene]-5-keto-3-methyl-2-pyrazolin-1-yl]benzenesulfonamide Formula: C21H15ClN4O6S MolecularWeight: 486.885

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1=CC2=CC=C(O2)C3=CC(=C(C=C3)Cl)[N+](=O)[O-])C4=CC=C(C=C4)S(=O)(=O)N

Isomeric SMILES

CC\1=NN(C(=O)/C1=C\C2=CC=C(O2)C3=CC(=C(C=C3)Cl)[N+](=O)[O-])C4=CC=C(C=C4)S(=O)(=O)N

InChI

InChI=1S/C21H15ClN4O6S/c1-12-17(21(27)25(24-12)14-3-6-16(7-4-14)33(23,30)31)11-15-5-9-20(32-15)13-2-8-18(22)19(10-13)26(28)29/h2-11H,1H3,(H2,23,30,31)/b17-11-