6-[(2-bromophenyl)sulfanylmethyl]-N2-(4-fluorophenyl)-1,3,5-triazine-2,4-diamine

Systemtic Name: 6-[(2-bromophenyl)sulfanylmethyl]-N2-(4-fluorophenyl)-1,3,5-triazine-2,4-diamine Openeye Name: 6-[(2-bromophenyl)sulfanylmethyl]-N2-(4-fluorophenyl)-1,3,5-triazine-2,4-diamine CAS Name: 6-[[(2-bromophenyl)thio]methyl]-N2-(4-fluorophenyl)-1,3,5-triazine-2,4-diamine IUPAC Name: 6-[(2-bromophenyl)sulfanylmethyl]-2-N-(4-fluorophenyl)-1,3,5-triazine-2,4-diamine Traditional Name: [4-amino-6-[[(2-bromophenyl)thio]methyl]-s-triazin-2-yl]-(4-fluorophenyl)amine Formula: C16H13BrFN5S MolecularWeight: 406.275323

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)SCC2=NC(=NC(=N2)NC3=CC=C(C=C3)F)N)Br

Isomeric SMILES

C1=CC=C(C(=C1)SCC2=NC(=NC(=N2)NC3=CC=C(C=C3)F)N)Br

InChI

InChI=1S/C16H13BrFN5S/c17-12-3-1-2-4-13(12)24-9-14-21-15(19)23-16(22-14)20-11-7-5-10(18)6-8-11/h1-8H,9H2,(H3,19,20,21,22,23)