5-tert-butyl-N-[3-[(3-chlorophenyl)amino]quinoxalin-2-yl]-2-methyl-benzenesulfonamide

Systemtic Name: 5-tert-butyl-N-[3-[(3-chlorophenyl)amino]quinoxalin-2-yl]-2-methyl-benzenesulfonamide Openeye Name: 5-tert-butyl-N-[3-(3-chloroanilino)quinoxalin-2-yl]-2-methyl-benzenesulfonamide CAS Name: 5-tert-butyl-N-[3-(3-chloroanilino)-2-quinoxalinyl]-2-methylbenzenesulfonamide IUPAC Name: 5-tert-butyl-N-[3-(3-chloroanilino)quinoxalin-2-yl]-2-methylbenzenesulfonamide Traditional Name: 5-tert-butyl-N-[3-(3-chloroanilino)quinoxalin-2-yl]-2-methyl-benzenesulfonamide Formula: C25H25ClN4O2S MolecularWeight: 481.0096

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(C)(C)C)S(=O)(=O)NC2=NC3=CC=CC=C3N=C2NC4=CC(=CC=C4)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)C(C)(C)C)S(=O)(=O)NC2=NC3=CC=CC=C3N=C2NC4=CC(=CC=C4)Cl

InChI

InChI=1S/C25H25ClN4O2S/c1-16-12-13-17(25(2,3)4)14-22(16)33(31,32)30-24-23(27-19-9-7-8-18(26)15-19)28-20-10-5-6-11-21(20)29-24/h5-15H,1-4H3,(H,27,28)(H,29,30)