2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-N-[(4-sulfamoylphenyl)methyl]ethanamide

Systemtic Name: 2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-N-[(4-sulfamoylphenyl)methyl]ethanamide Openeye Name: 2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-N-[(4-sulfamoylphenyl)methyl]acetamide CAS Name: 2-(3,5-dimethyl-4-nitro-1-pyrazolyl)-N-[(4-sulfamoylphenyl)methyl]acetamide IUPAC Name: 2-(3,5-dimethyl-4-nitropyrazol-1-yl)-N-[(4-sulfamoylphenyl)methyl]acetamide Traditional Name: 2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-N-(4-sulfamoylbenzyl)acetamide Formula: C14H17N5O5S MolecularWeight: 367.38028

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC(=O)NCC2=CC=C(C=C2)S(=O)(=O)N)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CC(=O)NCC2=CC=C(C=C2)S(=O)(=O)N)C)[N+](=O)[O-]

InChI

InChI=1S/C14H17N5O5S/c1-9-14(19(21)22)10(2)18(17-9)8-13(20)16-7-11-3-5-12(6-4-11)25(15,23)24/h3-6H,7-8H2,1-2H3,(H,16,20)(H2,15,23,24)