N-methyl-3-nitro-N-[[3-[2-[(3-nitrophenyl)amino]pyrimidin-4-yl]phenyl]methyl]benzenesulfonamide

Systemtic Name: N-methyl-3-nitro-N-[[3-[2-[(3-nitrophenyl)amino]pyrimidin-4-yl]phenyl]methyl]benzenesulfonamide Openeye Name: N-methyl-3-nitro-N-[[3-[2-(3-nitroanilino)pyrimidin-4-yl]phenyl]methyl]benzenesulfonamide CAS Name: N-methyl-3-nitro-N-[[3-[2-(3-nitroanilino)-4-pyrimidinyl]phenyl]methyl]benzenesulfonamide IUPAC Name: N-methyl-3-nitro-N-[[3-[2-(3-nitroanilino)pyrimidin-4-yl]phenyl]methyl]benzenesulfonamide Traditional Name: N-methyl-3-nitro-N-[3-[2-(3-nitroanilino)pyrimidin-4-yl]benzyl]benzenesulfonamide Formula: C24H20N6O6S MolecularWeight: 520.5172

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC(=C1)C2=NC(=NC=C2)NC3=CC(=CC=C3)[N+](=O)[O-])S(=O)(=O)C4=CC=CC(=C4)[N+](=O)[O-]

Isomeric SMILES

CN(CC1=CC=CC(=C1)C2=NC(=NC=C2)NC3=CC(=CC=C3)[N+](=O)[O-])S(=O)(=O)C4=CC=CC(=C4)[N+](=O)[O-]

InChI

InChI=1S/C24H20N6O6S/c1-28(37(35,36)22-10-4-9-21(15-22)30(33)34)16-17-5-2-6-18(13-17)23-11-12-25-24(27-23)26-19-7-3-8-20(14-19)29(31)32/h2-15H,16H2,1H3,(H,25,26,27)