(4-azanyl-6-phenylazanyl-1,3,5-triazin-2-yl)methyl 3-(4-fluorophenyl)imidazole-4-carboxylate

Systemtic Name: (4-azanyl-6-phenylazanyl-1,3,5-triazin-2-yl)methyl 3-(4-fluorophenyl)imidazole-4-carboxylate Openeye Name: (4-amino-6-anilino-1,3,5-triazin-2-yl)methyl 3-(4-fluorophenyl)imidazole-4-carboxylate CAS Name: 3-(4-fluorophenyl)-4-imidazolecarboxylic acid (4-amino-6-anilino-1,3,5-triazin-2-yl)methyl ester IUPAC Name: (4-amino-6-anilino-1,3,5-triazin-2-yl)methyl 3-(4-fluorophenyl)imidazole-4-carboxylate Traditional Name: 3-(4-fluorophenyl)imidazole-4-carboxylic acid (4-amino-6-anilino-s-triazin-2-yl)methyl ester Formula: C20H16FN7O2 MolecularWeight: 405.385143

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=NC(=NC(=N2)N)COC(=O)C3=CN=CN3C4=CC=C(C=C4)F

Isomeric SMILES

C1=CC=C(C=C1)NC2=NC(=NC(=N2)N)COC(=O)C3=CN=CN3C4=CC=C(C=C4)F

InChI

InChI=1S/C20H16FN7O2/c21-13-6-8-15(9-7-13)28-12-23-10-16(28)18(29)30-11-17-25-19(22)27-20(26-17)24-14-4-2-1-3-5-14/h1-10,12H,11H2,(H3,22,24,25,26,27)