2-[(4,6-dimethoxy-1,3,5-triazin-2-yl)-methylsulfanyl-methyl]-6-fluoranyl-aniline

Systemtic Name: 2-[(4,6-dimethoxy-1,3,5-triazin-2-yl)-methylsulfanyl-methyl]-6-fluoranyl-aniline Openeye Name: 2-[(4,6-dimethoxy-1,3,5-triazin-2-yl)-methylsulfanyl-methyl]-6-fluoro-aniline CAS Name: 2-[(4,6-dimethoxy-1,3,5-triazin-2-yl)-(methylthio)methyl]-6-fluoroaniline IUPAC Name: 2-[(4,6-dimethoxy-1,3,5-triazin-2-yl)-methylsulfanylmethyl]-6-fluoroaniline Traditional Name: [2-[(4,6-dimethoxy-s-triazin-2-yl)-(methylthio)methyl]-6-fluoro-phenyl]amine Formula: C13H15FN4O2S MolecularWeight: 310.347203

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC(=NC(=N1)C(C2=C(C(=CC=C2)F)N)SC)OC

Isomeric SMILES

COC1=NC(=NC(=N1)C(C2=C(C(=CC=C2)F)N)SC)OC

InChI

InChI=1S/C13H15FN4O2S/c1-19-12-16-11(17-13(18-12)20-2)10(21-3)7-5-4-6-8(14)9(7)15/h4-6,10H,15H2,1-3H3