N-[3-[(4-butan-2-ylphenyl)amino]quinoxalin-2-yl]-4-methyl-benzenesulfonamide

Systemtic Name: N-[3-[(4-butan-2-ylphenyl)amino]quinoxalin-2-yl]-4-methyl-benzenesulfonamide Openeye Name: 4-methyl-N-[3-(4-sec-butylanilino)quinoxalin-2-yl]benzenesulfonamide CAS Name: N-[3-(4-butan-2-ylanilino)-2-quinoxalinyl]-4-methylbenzenesulfonamide IUPAC Name: N-[3-(4-butan-2-ylanilino)quinoxalin-2-yl]-4-methylbenzenesulfonamide Traditional Name: 4-methyl-N-[3-(4-sec-butylanilino)quinoxalin-2-yl]benzenesulfonamide Formula: C25H26N4O2S MolecularWeight: 446.56454

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)NC2=NC3=CC=CC=C3N=C2NS(=O)(=O)C4=CC=C(C=C4)C

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)NC2=NC3=CC=CC=C3N=C2NS(=O)(=O)C4=CC=C(C=C4)C

InChI

InChI=1S/C25H26N4O2S/c1-4-18(3)19-11-13-20(14-12-19)26-24-25(28-23-8-6-5-7-22(23)27-24)29-32(30,31)21-15-9-17(2)10-16-21/h5-16,18H,4H2,1-3H3,(H,26,27)(H,28,29)