4-chloranyl-N-[3-[(3-fluorophenyl)amino]-6-methyl-quinoxalin-2-yl]benzenesulfonamide

Systemtic Name: 4-chloranyl-N-[3-[(3-fluorophenyl)amino]-6-methyl-quinoxalin-2-yl]benzenesulfonamide Openeye Name: 4-chloro-N-[3-(3-fluoroanilino)-6-methyl-quinoxalin-2-yl]benzenesulfonamide CAS Name: 4-chloro-N-[3-(3-fluoroanilino)-6-methyl-2-quinoxalinyl]benzenesulfonamide IUPAC Name: 4-chloro-N-[3-(3-fluoroanilino)-6-methylquinoxalin-2-yl]benzenesulfonamide Traditional Name: 4-chloro-N-[3-(3-fluoroanilino)-6-methyl-quinoxalin-2-yl]benzenesulfonamide Formula: C21H16ClFN4O2S MolecularWeight: 442.893743

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(C(=N2)NC3=CC(=CC=C3)F)NS(=O)(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(C(=N2)NC3=CC(=CC=C3)F)NS(=O)(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C21H16ClFN4O2S/c1-13-5-10-18-19(11-13)26-20(24-16-4-2-3-15(23)12-16)21(25-18)27-30(28,29)17-8-6-14(22)7-9-17/h2-12H,1H3,(H,24,26)(H,25,27)