N-[(1-ethylpyrazol-3-yl)methyl]-4-nitro-N-(4-propan-2-ylphenyl)benzenesulfonamide

Systemtic Name: N-[(1-ethylpyrazol-3-yl)methyl]-4-nitro-N-(4-propan-2-ylphenyl)benzenesulfonamide Openeye Name: N-[(1-ethylpyrazol-3-yl)methyl]-N-(4-isopropylphenyl)-4-nitro-benzenesulfonamide CAS Name: N-[(1-ethyl-3-pyrazolyl)methyl]-4-nitro-N-(4-propan-2-ylphenyl)benzenesulfonamide IUPAC Name: N-[(1-ethylpyrazol-3-yl)methyl]-4-nitro-N-(4-propan-2-ylphenyl)benzenesulfonamide Traditional Name: N-[(1-ethylpyrazol-3-yl)methyl]-4-nitro-N-p-cumenyl-benzenesulfonamide Formula: C21H24N4O4S MolecularWeight: 428.50466

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=CC(=N1)CN(C2=CC=C(C=C2)C(C)C)S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCN1C=CC(=N1)CN(C2=CC=C(C=C2)C(C)C)S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H24N4O4S/c1-4-23-14-13-18(22-23)15-24(19-7-5-17(6-8-19)16(2)3)30(28,29)21-11-9-20(10-12-21)25(26)27/h5-14,16H,4,15H2,1-3H3