(4-azanyl-6-phenylazanyl-1,3,5-triazin-2-yl)methyl 2-(3-fluoranyl-4-methoxy-phenyl)ethanoate

Systemtic Name: (4-azanyl-6-phenylazanyl-1,3,5-triazin-2-yl)methyl 2-(3-fluoranyl-4-methoxy-phenyl)ethanoate Openeye Name: (4-amino-6-anilino-1,3,5-triazin-2-yl)methyl 2-(3-fluoro-4-methoxy-phenyl)acetate CAS Name: 2-(3-fluoro-4-methoxyphenyl)acetic 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 2-(3-fluoro-4-methoxyphenyl)acetate Traditional Name: 2-(3-fluoro-4-methoxy-phenyl)acetic acid (4-amino-6-anilino-s-triazin-2-yl)methyl ester Formula: C19H18FN5O3 MolecularWeight: 383.376323

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CC(=O)OCC2=NC(=NC(=N2)NC3=CC=CC=C3)N)F

Isomeric SMILES

COC1=C(C=C(C=C1)CC(=O)OCC2=NC(=NC(=N2)NC3=CC=CC=C3)N)F

InChI

InChI=1S/C19H18FN5O3/c1-27-15-8-7-12(9-14(15)20)10-17(26)28-11-16-23-18(21)25-19(24-16)22-13-5-3-2-4-6-13/h2-9H,10-11H2,1H3,(H3,21,22,23,24,25)