4-azanyl-N-[3-[(3-methylphenyl)amino]quinoxalin-2-yl]benzenesulfonamide

Systemtic Name: 4-azanyl-N-[3-[(3-methylphenyl)amino]quinoxalin-2-yl]benzenesulfonamide Openeye Name: 4-amino-N-[3-(3-methylanilino)quinoxalin-2-yl]benzenesulfonamide CAS Name: 4-amino-N-[3-(3-methylanilino)-2-quinoxalinyl]benzenesulfonamide IUPAC Name: 4-amino-N-[3-(3-methylanilino)quinoxalin-2-yl]benzenesulfonamide Traditional Name: 4-amino-N-[3-(m-toluidino)quinoxalin-2-yl]benzenesulfonamide Formula: C21H19N5O2S MolecularWeight: 405.47286

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC2=NC3=CC=CC=C3N=C2NS(=O)(=O)C4=CC=C(C=C4)N

Isomeric SMILES

CC1=CC(=CC=C1)NC2=NC3=CC=CC=C3N=C2NS(=O)(=O)C4=CC=C(C=C4)N

InChI

InChI=1S/C21H19N5O2S/c1-14-5-4-6-16(13-14)23-20-21(25-19-8-3-2-7-18(19)24-20)26-29(27,28)17-11-9-15(22)10-12-17/h2-13H,22H2,1H3,(H,23,24)(H,25,26)