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

Systemtic Name: (4-azanyl-6-phenylazanyl-1,3,5-triazin-2-yl)methyl 2-(6-methoxy-1-benzofuran-3-yl)ethanoate Openeye Name: (4-amino-6-anilino-1,3,5-triazin-2-yl)methyl 2-(6-methoxybenzofuran-3-yl)acetate CAS Name: 2-(6-methoxy-3-benzofuranyl)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-(6-methoxy-1-benzofuran-3-yl)acetate Traditional Name: 2-(6-methoxybenzofuran-3-yl)acetic acid (4-amino-6-anilino-s-triazin-2-yl)methyl ester Formula: C21H19N5O4 MolecularWeight: 405.40666

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=CO2)CC(=O)OCC3=NC(=NC(=N3)NC4=CC=CC=C4)N

Isomeric SMILES

COC1=CC2=C(C=C1)C(=CO2)CC(=O)OCC3=NC(=NC(=N3)NC4=CC=CC=C4)N

InChI

InChI=1S/C21H19N5O4/c1-28-15-7-8-16-13(11-29-17(16)10-15)9-19(27)30-12-18-24-20(22)26-21(25-18)23-14-5-3-2-4-6-14/h2-8,10-11H,9,12H2,1H3,(H3,22,23,24,25,26)