N-[3-(benzotriazol-2-yl)-2-methoxy-5-methyl-phenyl]-4-fluoranyl-benzenesulfonamide

Systemtic Name: N-[3-(benzotriazol-2-yl)-2-methoxy-5-methyl-phenyl]-4-fluoranyl-benzenesulfonamide Openeye Name: N-[3-(benzotriazol-2-yl)-2-methoxy-5-methyl-phenyl]-4-fluoro-benzenesulfonamide CAS Name: N-[3-(2-benzotriazolyl)-2-methoxy-5-methylphenyl]-4-fluorobenzenesulfonamide IUPAC Name: N-[3-(benzotriazol-2-yl)-2-methoxy-5-methylphenyl]-4-fluorobenzenesulfonamide Traditional Name: N-[3-(benzotriazol-2-yl)-2-methoxy-5-methyl-phenyl]-4-fluoro-benzenesulfonamide Formula: C20H17FN4O3S MolecularWeight: 412.437383

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)NS(=O)(=O)C2=CC=C(C=C2)F)OC)N3N=C4C=CC=CC4=N3

Isomeric SMILES

CC1=CC(=C(C(=C1)NS(=O)(=O)C2=CC=C(C=C2)F)OC)N3N=C4C=CC=CC4=N3

InChI

InChI=1S/C20H17FN4O3S/c1-13-11-18(24-29(26,27)15-9-7-14(21)8-10-15)20(28-2)19(12-13)25-22-16-5-3-4-6-17(16)23-25/h3-12,24H,1-2H3