4-[[2-(2,4-dinitrophenyl)-5-methyl-pyrazol-3-yl]amino]-N-pyrimidin-2-yl-benzenesulfonamide

Systemtic Name: 4-[[2-(2,4-dinitrophenyl)-5-methyl-pyrazol-3-yl]amino]-N-pyrimidin-2-yl-benzenesulfonamide Openeye Name: 4-[[2-(2,4-dinitrophenyl)-5-methyl-pyrazol-3-yl]amino]-N-pyrimidin-2-yl-benzenesulfonamide CAS Name: 4-[[2-(2,4-dinitrophenyl)-5-methyl-3-pyrazolyl]amino]-N-(2-pyrimidinyl)benzenesulfonamide IUPAC Name: 4-[[2-(2,4-dinitrophenyl)-5-methylpyrazol-3-yl]amino]-N-pyrimidin-2-ylbenzenesulfonamide Traditional Name: 4-[[2-(2,4-dinitrophenyl)-5-methyl-pyrazol-3-yl]amino]-N-(2-pyrimidyl)benzenesulfonamide Formula: C20H16N8O6S MolecularWeight: 496.45604

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)NC2=CC=C(C=C2)S(=O)(=O)NC3=NC=CC=N3)C4=C(C=C(C=C4)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=NN(C(=C1)NC2=CC=C(C=C2)S(=O)(=O)NC3=NC=CC=N3)C4=C(C=C(C=C4)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C20H16N8O6S/c1-13-11-19(26(24-13)17-8-5-15(27(29)30)12-18(17)28(31)32)23-14-3-6-16(7-4-14)35(33,34)25-20-21-9-2-10-22-20/h2-12,23H,1H3,(H,21,22,25)