N-ethyl-3-nitro-N-phenyl-4-[[2-(pyrazol-1-ylmethyl)phenyl]methylamino]benzenesulfonamide

Systemtic Name: N-ethyl-3-nitro-N-phenyl-4-[[2-(pyrazol-1-ylmethyl)phenyl]methylamino]benzenesulfonamide Openeye Name: N-ethyl-3-nitro-N-phenyl-4-[[2-(pyrazol-1-ylmethyl)phenyl]methylamino]benzenesulfonamide CAS Name: N-ethyl-3-nitro-N-phenyl-4-[[2-(1-pyrazolylmethyl)phenyl]methylamino]benzenesulfonamide IUPAC Name: N-ethyl-3-nitro-N-phenyl-4-[[2-(pyrazol-1-ylmethyl)phenyl]methylamino]benzenesulfonamide Traditional Name: N-ethyl-3-nitro-N-phenyl-4-[[2-(pyrazol-1-ylmethyl)benzyl]amino]benzenesulfonamide Formula: C25H25N5O4S MolecularWeight: 491.5621

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=CC=C1)S(=O)(=O)C2=CC(=C(C=C2)NCC3=CC=CC=C3CN4C=CC=N4)[N+](=O)[O-]

Isomeric SMILES

CCN(C1=CC=CC=C1)S(=O)(=O)C2=CC(=C(C=C2)NCC3=CC=CC=C3CN4C=CC=N4)[N+](=O)[O-]

InChI

InChI=1S/C25H25N5O4S/c1-2-29(22-11-4-3-5-12-22)35(33,34)23-13-14-24(25(17-23)30(31)32)26-18-20-9-6-7-10-21(20)19-28-16-8-15-27-28/h3-17,26H,2,18-19H2,1H3