N-[4-(4-methoxyphenyl)-6-phenyl-pyrimidin-2-yl]-3-nitro-benzenesulfonamide

Systemtic Name: N-[4-(4-methoxyphenyl)-6-phenyl-pyrimidin-2-yl]-3-nitro-benzenesulfonamide Openeye Name: N-[4-(4-methoxyphenyl)-6-phenyl-pyrimidin-2-yl]-3-nitro-benzenesulfonamide CAS Name: N-[4-(4-methoxyphenyl)-6-phenyl-2-pyrimidinyl]-3-nitrobenzenesulfonamide IUPAC Name: N-[4-(4-methoxyphenyl)-6-phenylpyrimidin-2-yl]-3-nitrobenzenesulfonamide Traditional Name: N-[4-(4-methoxyphenyl)-6-phenyl-pyrimidin-2-yl]-3-nitro-benzenesulfonamide Formula: C23H18N4O5S MolecularWeight: 462.47782

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NC(=NC(=C2)C3=CC=CC=C3)NS(=O)(=O)C4=CC=CC(=C4)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)C2=NC(=NC(=C2)C3=CC=CC=C3)NS(=O)(=O)C4=CC=CC(=C4)[N+](=O)[O-]

InChI

InChI=1S/C23H18N4O5S/c1-32-19-12-10-17(11-13-19)22-15-21(16-6-3-2-4-7-16)24-23(25-22)26-33(30,31)20-9-5-8-18(14-20)27(28)29/h2-15H,1H3,(H,24,25,26)