4-[(3-nitrophenyl)methylsulfonylamino]-N-pyrimidin-2-yl-benzenesulfonamide

Systemtic Name: 4-[(3-nitrophenyl)methylsulfonylamino]-N-pyrimidin-2-yl-benzenesulfonamide Openeye Name: 4-[(3-nitrophenyl)methylsulfonylamino]-N-pyrimidin-2-yl-benzenesulfonamide CAS Name: 4-[(3-nitrophenyl)methylsulfonylamino]-N-(2-pyrimidinyl)benzenesulfonamide IUPAC Name: 4-[(3-nitrophenyl)methylsulfonylamino]-N-pyrimidin-2-ylbenzenesulfonamide Traditional Name: 4-[(3-nitrobenzyl)sulfonylamino]-N-(2-pyrimidyl)benzenesulfonamide Formula: C17H15N5O6S2 MolecularWeight: 449.4609

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H15N5O6S2/c23-22(24)15-4-1-3-13(11-15)12-29(25,26)20-14-5-7-16(8-6-14)30(27,28)21-17-18-9-2-10-19-17/h1-11,20H,12H2,(H,18,19,21)