2-ethyl-4-nitro-N-[(4-sulfamoylphenyl)methyl]pyrazole-3-carboxamide

Systemtic Name: 2-ethyl-4-nitro-N-[(4-sulfamoylphenyl)methyl]pyrazole-3-carboxamide Openeye Name: 2-ethyl-4-nitro-N-[(4-sulfamoylphenyl)methyl]pyrazole-3-carboxamide CAS Name: 2-ethyl-4-nitro-N-[(4-sulfamoylphenyl)methyl]-3-pyrazolecarboxamide IUPAC Name: 2-ethyl-4-nitro-N-[(4-sulfamoylphenyl)methyl]pyrazole-3-carboxamide Traditional Name: 2-ethyl-4-nitro-N-(4-sulfamoylbenzyl)pyrazole-3-carboxamide Formula: C13H15N5O5S MolecularWeight: 353.3537

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C=N1)[N+](=O)[O-])C(=O)NCC2=CC=C(C=C2)S(=O)(=O)N

Isomeric SMILES

CCN1C(=C(C=N1)[N+](=O)[O-])C(=O)NCC2=CC=C(C=C2)S(=O)(=O)N

InChI

InChI=1S/C13H15N5O5S/c1-2-17-12(11(8-16-17)18(20)21)13(19)15-7-9-3-5-10(6-4-9)24(14,22)23/h3-6,8H,2,7H2,1H3,(H,15,19)(H2,14,22,23)