[4-azanyl-6-[(2-methylphenyl)amino]-1,3,5-triazin-2-yl]methyl 5-methoxy-3-methyl-1-benzofuran-2-carboxylate

Systemtic Name: [4-azanyl-6-[(2-methylphenyl)amino]-1,3,5-triazin-2-yl]methyl 5-methoxy-3-methyl-1-benzofuran-2-carboxylate Openeye Name: [4-amino-6-(2-methylanilino)-1,3,5-triazin-2-yl]methyl 5-methoxy-3-methyl-benzofuran-2-carboxylate CAS Name: 5-methoxy-3-methyl-2-benzofurancarboxylic acid [4-amino-6-(2-methylanilino)-1,3,5-triazin-2-yl]methyl ester IUPAC Name: [4-amino-6-(2-methylanilino)-1,3,5-triazin-2-yl]methyl 5-methoxy-3-methyl-1-benzofuran-2-carboxylate Traditional Name: 5-methoxy-3-methyl-coumarilic acid [4-amino-6-(o-toluidino)-s-triazin-2-yl]methyl ester Formula: C22H21N5O4 MolecularWeight: 419.43324

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC2=NC(=NC(=N2)N)COC(=O)C3=C(C4=C(O3)C=CC(=C4)OC)C

Isomeric SMILES

CC1=CC=CC=C1NC2=NC(=NC(=N2)N)COC(=O)C3=C(C4=C(O3)C=CC(=C4)OC)C

InChI

InChI=1S/C22H21N5O4/c1-12-6-4-5-7-16(12)24-22-26-18(25-21(23)27-22)11-30-20(28)19-13(2)15-10-14(29-3)8-9-17(15)31-19/h4-10H,11H2,1-3H3,(H3,23,24,25,26,27)