N-ethyl-3-nitro-N-phenyl-4-[[3-(1,2,4-triazol-1-ylmethyl)phenyl]amino]benzenesulfonamide

Systemtic Name: N-ethyl-3-nitro-N-phenyl-4-[[3-(1,2,4-triazol-1-ylmethyl)phenyl]amino]benzenesulfonamide Openeye Name: N-ethyl-3-nitro-N-phenyl-4-[3-(1,2,4-triazol-1-ylmethyl)anilino]benzenesulfonamide CAS Name: N-ethyl-3-nitro-N-phenyl-4-[3-(1,2,4-triazol-1-ylmethyl)anilino]benzenesulfonamide IUPAC Name: N-ethyl-3-nitro-N-phenyl-4-[3-(1,2,4-triazol-1-ylmethyl)anilino]benzenesulfonamide Traditional Name: N-ethyl-3-nitro-N-phenyl-4-[3-(1,2,4-triazol-1-ylmethyl)anilino]benzenesulfonamide Formula: C23H22N6O4S MolecularWeight: 478.52358

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=CC=C1)S(=O)(=O)C2=CC(=C(C=C2)NC3=CC=CC(=C3)CN4C=NC=N4)[N+](=O)[O-]

Isomeric SMILES

CCN(C1=CC=CC=C1)S(=O)(=O)C2=CC(=C(C=C2)NC3=CC=CC(=C3)CN4C=NC=N4)[N+](=O)[O-]

InChI

InChI=1S/C23H22N6O4S/c1-2-28(20-9-4-3-5-10-20)34(32,33)21-11-12-22(23(14-21)29(30)31)26-19-8-6-7-18(13-19)15-27-17-24-16-25-27/h3-14,16-17,26H,2,15H2,1H3