tert-butyl 6-fluoranyl-5-(4-methylphenyl)sulfonyl-4H-imidazo[1,5-a]quinoxaline-3-carboxylate

Systemtic Name: tert-butyl 6-fluoranyl-5-(4-methylphenyl)sulfonyl-4H-imidazo[1,5-a]quinoxaline-3-carboxylate Openeye Name: tert-butyl 6-fluoro-5-(p-tolylsulfonyl)-4H-imidazo[1,5-a]quinoxaline-3-carboxylate CAS Name: 6-fluoro-5-(4-methylphenyl)sulfonyl-4H-imidazo[1,5-a]quinoxaline-3-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 6-fluoro-5-(4-methylphenyl)sulfonyl-4H-imidazo[1,5-a]quinoxaline-3-carboxylate Traditional Name: 6-fluoro-5-tosyl-4H-imidazo[1,5-a]quinoxaline-3-carboxylic acid tert-butyl ester Formula: C22H22FN3O4S MolecularWeight: 443.491183

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CC3=C(N=CN3C4=C2C(=CC=C4)F)C(=O)OC(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CC3=C(N=CN3C4=C2C(=CC=C4)F)C(=O)OC(C)(C)C

InChI

InChI=1S/C22H22FN3O4S/c1-14-8-10-15(11-9-14)31(28,29)26-12-18-19(21(27)30-22(2,3)4)24-13-25(18)17-7-5-6-16(23)20(17)26/h5-11,13H,12H2,1-4H3