[4-azanyl-6-[(2-methoxyphenyl)amino]-1,3,5-triazin-2-yl]methyl 7-fluoranyl-3-methyl-1-benzofuran-2-carboxylate

Systemtic Name: [4-azanyl-6-[(2-methoxyphenyl)amino]-1,3,5-triazin-2-yl]methyl 7-fluoranyl-3-methyl-1-benzofuran-2-carboxylate Openeye Name: [4-amino-6-(2-methoxyanilino)-1,3,5-triazin-2-yl]methyl 7-fluoro-3-methyl-benzofuran-2-carboxylate CAS Name: 7-fluoro-3-methyl-2-benzofurancarboxylic acid [4-amino-6-(2-methoxyanilino)-1,3,5-triazin-2-yl]methyl ester IUPAC Name: [4-amino-6-(2-methoxyanilino)-1,3,5-triazin-2-yl]methyl 7-fluoro-3-methyl-1-benzofuran-2-carboxylate Traditional Name: 7-fluoro-3-methyl-coumarilic acid [4-amino-6-(o-anisidino)-s-triazin-2-yl]methyl ester Formula: C21H18FN5O4 MolecularWeight: 423.397123

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C=CC=C2F)C(=O)OCC3=NC(=NC(=N3)NC4=CC=CC=C4OC)N

Isomeric SMILES

CC1=C(OC2=C1C=CC=C2F)C(=O)OCC3=NC(=NC(=N3)NC4=CC=CC=C4OC)N

InChI

InChI=1S/C21H18FN5O4/c1-11-12-6-5-7-13(22)18(12)31-17(11)19(28)30-10-16-25-20(23)27-21(26-16)24-14-8-3-4-9-15(14)29-2/h3-9H,10H2,1-2H3,(H3,23,24,25,26,27)