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

Systemtic Name: N-[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]-3-(3-nitropyrazol-1-yl)propanamide Openeye Name: N-[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]-3-(3-nitropyrazol-1-yl)propanamide CAS Name: N-[4-[(4,6-dimethyl-2-pyrimidinyl)sulfamoyl]phenyl]-3-(3-nitro-1-pyrazolyl)propanamide IUPAC Name: N-[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]-3-(3-nitropyrazol-1-yl)propanamide Traditional Name: N-[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]-3-(3-nitropyrazol-1-yl)propionamide Formula: C18H19N7O5S MolecularWeight: 445.45236

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)CCN3C=CC(=N3)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=NC(=N1)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)CCN3C=CC(=N3)[N+](=O)[O-])C

InChI

InChI=1S/C18H19N7O5S/c1-12-11-13(2)20-18(19-12)23-31(29,30)15-5-3-14(4-6-15)21-17(26)8-10-24-9-7-16(22-24)25(27)28/h3-7,9,11H,8,10H2,1-2H3,(H,21,26)(H,19,20,23)