6-[(4-bromanyl-2-fluoranyl-phenoxy)methyl]-N2-(2-methylphenyl)-1,3,5-triazine-2,4-diamine

Systemtic Name: 6-[(4-bromanyl-2-fluoranyl-phenoxy)methyl]-N2-(2-methylphenyl)-1,3,5-triazine-2,4-diamine Openeye Name: 6-[(4-bromo-2-fluoro-phenoxy)methyl]-N2-(o-tolyl)-1,3,5-triazine-2,4-diamine CAS Name: 6-[(4-bromo-2-fluorophenoxy)methyl]-N2-(2-methylphenyl)-1,3,5-triazine-2,4-diamine IUPAC Name: 6-[(4-bromo-2-fluorophenoxy)methyl]-2-N-(2-methylphenyl)-1,3,5-triazine-2,4-diamine Traditional Name: [4-amino-6-[(4-bromo-2-fluoro-phenoxy)methyl]-s-triazin-2-yl]-(o-tolyl)amine Formula: C17H15BrFN5O MolecularWeight: 404.236303

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC2=NC(=NC(=N2)N)COC3=C(C=C(C=C3)Br)F

Isomeric SMILES

CC1=CC=CC=C1NC2=NC(=NC(=N2)N)COC3=C(C=C(C=C3)Br)F

InChI

InChI=1S/C17H15BrFN5O/c1-10-4-2-3-5-13(10)21-17-23-15(22-16(20)24-17)9-25-14-7-6-11(18)8-12(14)19/h2-8H,9H2,1H3,(H3,20,21,22,23,24)