N-tert-butyl-3-nitro-4-[(3-pyrazin-2-yloxyphenyl)amino]benzenesulfonamide

Systemtic Name: N-tert-butyl-3-nitro-4-[(3-pyrazin-2-yloxyphenyl)amino]benzenesulfonamide Openeye Name: N-tert-butyl-3-nitro-4-(3-pyrazin-2-yloxyanilino)benzenesulfonamide CAS Name: N-tert-butyl-3-nitro-4-[3-(2-pyrazinyloxy)anilino]benzenesulfonamide IUPAC Name: N-tert-butyl-3-nitro-4-(3-pyrazin-2-yloxyanilino)benzenesulfonamide Traditional Name: N-tert-butyl-3-nitro-4-(3-pyrazin-2-yloxyanilino)benzenesulfonamide Formula: C20H21N5O5S MolecularWeight: 443.47624

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NS(=O)(=O)C1=CC(=C(C=C1)NC2=CC(=CC=C2)OC3=NC=CN=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)NS(=O)(=O)C1=CC(=C(C=C1)NC2=CC(=CC=C2)OC3=NC=CN=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H21N5O5S/c1-20(2,3)24-31(28,29)16-7-8-17(18(12-16)25(26)27)23-14-5-4-6-15(11-14)30-19-13-21-9-10-22-19/h4-13,23-24H,1-3H3