N-[3-[(2,5-dimethylphenyl)amino]-6-nitro-quinoxalin-2-yl]-4-methyl-benzenesulfonamide

Systemtic Name: N-[3-[(2,5-dimethylphenyl)amino]-6-nitro-quinoxalin-2-yl]-4-methyl-benzenesulfonamide Openeye Name: N-[3-(2,5-dimethylanilino)-6-nitro-quinoxalin-2-yl]-4-methyl-benzenesulfonamide CAS Name: N-[3-(2,5-dimethylanilino)-6-nitro-2-quinoxalinyl]-4-methylbenzenesulfonamide IUPAC Name: N-[3-(2,5-dimethylanilino)-6-nitroquinoxalin-2-yl]-4-methylbenzenesulfonamide Traditional Name: N-[3-(2,5-dimethylanilino)-6-nitro-quinoxalin-2-yl]-4-methyl-benzenesulfonamide Formula: C23H21N5O4S MolecularWeight: 463.50894

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC2=NC3=C(C=C(C=C3)[N+](=O)[O-])N=C2NC4=C(C=CC(=C4)C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC2=NC3=C(C=C(C=C3)[N+](=O)[O-])N=C2NC4=C(C=CC(=C4)C)C

InChI

InChI=1S/C23H21N5O4S/c1-14-5-9-18(10-6-14)33(31,32)27-23-22(25-20-12-15(2)4-7-16(20)3)26-21-13-17(28(29)30)8-11-19(21)24-23/h4-13H,1-3H3,(H,24,27)(H,25,26)