3-(3-nitropyrazol-1-yl)-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]propanamide

Systemtic Name: 3-(3-nitropyrazol-1-yl)-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]propanamide Openeye Name: 3-(3-nitropyrazol-1-yl)-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]propanamide CAS Name: 3-(3-nitro-1-pyrazolyl)-N-[4-(2-pyrimidinylsulfamoyl)phenyl]propanamide IUPAC Name: 3-(3-nitropyrazol-1-yl)-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]propanamide Traditional Name: 3-(3-nitropyrazol-1-yl)-N-[4-(2-pyrimidylsulfamoyl)phenyl]propionamide Formula: C16H15N7O5S MolecularWeight: 417.3992

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H15N7O5S/c24-15(7-11-22-10-6-14(20-22)23(25)26)19-12-2-4-13(5-3-12)29(27,28)21-16-17-8-1-9-18-16/h1-6,8-10H,7,11H2,(H,19,24)(H,17,18,21)