N-(2,6-dimethylpyrimidin-4-yl)-4-[(3,5-dinitropyridin-2-yl)amino]benzenesulfonamide

Systemtic Name: N-(2,6-dimethylpyrimidin-4-yl)-4-[(3,5-dinitropyridin-2-yl)amino]benzenesulfonamide Openeye Name: N-(2,6-dimethylpyrimidin-4-yl)-4-[(3,5-dinitro-2-pyridyl)amino]benzenesulfonamide CAS Name: N-(2,6-dimethyl-4-pyrimidinyl)-4-[(3,5-dinitro-2-pyridinyl)amino]benzenesulfonamide IUPAC Name: N-(2,6-dimethylpyrimidin-4-yl)-4-[(3,5-dinitropyridin-2-yl)amino]benzenesulfonamide Traditional Name: N-(2,6-dimethylpyrimidin-4-yl)-4-[(3,5-dinitro-2-pyridyl)amino]benzenesulfonamide Formula: C17H15N7O6S MolecularWeight: 445.4093

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)C)NS(=O)(=O)C2=CC=C(C=C2)NC3=C(C=C(C=N3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=NC(=N1)C)NS(=O)(=O)C2=CC=C(C=C2)NC3=C(C=C(C=N3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C17H15N7O6S/c1-10-7-16(20-11(2)19-10)22-31(29,30)14-5-3-12(4-6-14)21-17-15(24(27)28)8-13(9-18-17)23(25)26/h3-9H,1-2H3,(H,18,21)(H,19,20,22)