N-[4-[(2,6-dimethoxypyrimidin-4-yl)sulfamoyl]phenyl]-3-(4-nitropyrazol-1-yl)propanamide

Systemtic Name: N-[4-[(2,6-dimethoxypyrimidin-4-yl)sulfamoyl]phenyl]-3-(4-nitropyrazol-1-yl)propanamide Openeye Name: N-[4-[(2,6-dimethoxypyrimidin-4-yl)sulfamoyl]phenyl]-3-(4-nitropyrazol-1-yl)propanamide CAS Name: N-[4-[(2,6-dimethoxy-4-pyrimidinyl)sulfamoyl]phenyl]-3-(4-nitro-1-pyrazolyl)propanamide IUPAC Name: N-[4-[(2,6-dimethoxypyrimidin-4-yl)sulfamoyl]phenyl]-3-(4-nitropyrazol-1-yl)propanamide Traditional Name: N-[4-[(2,6-dimethoxypyrimidin-4-yl)sulfamoyl]phenyl]-3-(4-nitropyrazol-1-yl)propionamide Formula: C18H19N7O7S MolecularWeight: 477.45116

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC(=NC(=C1)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)CCN3C=C(C=N3)[N+](=O)[O-])OC

Isomeric SMILES

COC1=NC(=NC(=C1)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)CCN3C=C(C=N3)[N+](=O)[O-])OC

InChI

InChI=1S/C18H19N7O7S/c1-31-17-9-15(21-18(22-17)32-2)23-33(29,30)14-5-3-12(4-6-14)20-16(26)7-8-24-11-13(10-19-24)25(27)28/h3-6,9-11H,7-8H2,1-2H3,(H,20,26)(H,21,22,23)