N-(2-tert-butylsulfanylethyl)-4,6-bis(4-fluoranylphenoxy)-1,3,5-triazin-2-amine

Systemtic Name: N-(2-tert-butylsulfanylethyl)-4,6-bis(4-fluoranylphenoxy)-1,3,5-triazin-2-amine Openeye Name: N-(2-tert-butylsulfanylethyl)-4,6-bis(4-fluorophenoxy)-1,3,5-triazin-2-amine CAS Name: N-[2-(tert-butylthio)ethyl]-4,6-bis(4-fluorophenoxy)-1,3,5-triazin-2-amine IUPAC Name: N-(2-tert-butylsulfanylethyl)-4,6-bis(4-fluorophenoxy)-1,3,5-triazin-2-amine Traditional Name: [4,6-bis(4-fluorophenoxy)-s-triazin-2-yl]-[2-(tert-butylthio)ethyl]amine Formula: C21H22F2N4O2S MolecularWeight: 432.486786

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)SCCNC1=NC(=NC(=N1)OC2=CC=C(C=C2)F)OC3=CC=C(C=C3)F

Isomeric SMILES

CC(C)(C)SCCNC1=NC(=NC(=N1)OC2=CC=C(C=C2)F)OC3=CC=C(C=C3)F

InChI

InChI=1S/C21H22F2N4O2S/c1-21(2,3)30-13-12-24-18-25-19(28-16-8-4-14(22)5-9-16)27-20(26-18)29-17-10-6-15(23)7-11-17/h4-11H,12-13H2,1-3H3,(H,24,25,26,27)