N-(4,6-dimethylpyrimidin-2-yl)-4-[(2,6-dinitro-4-piperidin-1-ylcarbonyl-phenyl)amino]benzenesulfonamide

Systemtic Name: N-(4,6-dimethylpyrimidin-2-yl)-4-[(2,6-dinitro-4-piperidin-1-ylcarbonyl-phenyl)amino]benzenesulfonamide Openeye Name: N-(4,6-dimethylpyrimidin-2-yl)-4-[2,6-dinitro-4-(piperidine-1-carbonyl)anilino]benzenesulfonamide CAS Name: N-(4,6-dimethyl-2-pyrimidinyl)-4-[2,6-dinitro-4-[oxo(1-piperidinyl)methyl]anilino]benzenesulfonamide IUPAC Name: N-(4,6-dimethylpyrimidin-2-yl)-4-[2,6-dinitro-4-(piperidine-1-carbonyl)anilino]benzenesulfonamide Traditional Name: N-(4,6-dimethylpyrimidin-2-yl)-4-[2,6-dinitro-4-(piperidine-1-carbonyl)anilino]benzenesulfonamide Formula: C24H25N7O7S MolecularWeight: 555.563

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)NS(=O)(=O)C2=CC=C(C=C2)NC3=C(C=C(C=C3[N+](=O)[O-])C(=O)N4CCCCC4)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=NC(=N1)NS(=O)(=O)C2=CC=C(C=C2)NC3=C(C=C(C=C3[N+](=O)[O-])C(=O)N4CCCCC4)[N+](=O)[O-])C

InChI

InChI=1S/C24H25N7O7S/c1-15-12-16(2)26-24(25-15)28-39(37,38)19-8-6-18(7-9-19)27-22-20(30(33)34)13-17(14-21(22)31(35)36)23(32)29-10-4-3-5-11-29/h6-9,12-14,27H,3-5,10-11H2,1-2H3,(H,25,26,28)