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

Systemtic Name: 4-[(3,5-dinitropyridin-2-yl)amino]-N-(6-methoxypyrimidin-4-yl)benzenesulfonamide Openeye Name: 4-[(3,5-dinitro-2-pyridyl)amino]-N-(6-methoxypyrimidin-4-yl)benzenesulfonamide CAS Name: 4-[(3,5-dinitro-2-pyridinyl)amino]-N-(6-methoxy-4-pyrimidinyl)benzenesulfonamide IUPAC Name: 4-[(3,5-dinitropyridin-2-yl)amino]-N-(6-methoxypyrimidin-4-yl)benzenesulfonamide Traditional Name: 4-[(3,5-dinitro-2-pyridyl)amino]-N-(6-methoxypyrimidin-4-yl)benzenesulfonamide Formula: C16H13N7O7S MolecularWeight: 447.38212

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC=NC(=C1)NS(=O)(=O)C2=CC=C(C=C2)NC3=C(C=C(C=N3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

COC1=NC=NC(=C1)NS(=O)(=O)C2=CC=C(C=C2)NC3=C(C=C(C=N3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C16H13N7O7S/c1-30-15-7-14(18-9-19-15)21-31(28,29)12-4-2-10(3-5-12)20-16-13(23(26)27)6-11(8-17-16)22(24)25/h2-9H,1H3,(H,17,20)(H,18,19,21)