N-[(1-ethyl-3,5-dimethyl-pyrazol-4-yl)methyl]-N-methyl-3-nitro-benzenesulfonamide

Systemtic Name: N-[(1-ethyl-3,5-dimethyl-pyrazol-4-yl)methyl]-N-methyl-3-nitro-benzenesulfonamide Openeye Name: N-[(1-ethyl-3,5-dimethyl-pyrazol-4-yl)methyl]-N-methyl-3-nitro-benzenesulfonamide CAS Name: N-[(1-ethyl-3,5-dimethyl-4-pyrazolyl)methyl]-N-methyl-3-nitrobenzenesulfonamide IUPAC Name: N-[(1-ethyl-3,5-dimethylpyrazol-4-yl)methyl]-N-methyl-3-nitrobenzenesulfonamide Traditional Name: N-[(1-ethyl-3,5-dimethyl-pyrazol-4-yl)methyl]-N-methyl-3-nitro-benzenesulfonamide Formula: C15H20N4O4S MolecularWeight: 352.4087

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H20N4O4S/c1-5-18-12(3)15(11(2)16-18)10-17(4)24(22,23)14-8-6-7-13(9-14)19(20)21/h6-9H,5,10H2,1-4H3