6-(1,3-benzoxazol-2-ylsulfanylmethyl)-N2-(4-fluorophenyl)-1,3,5-triazine-2,4-diamine

Systemtic Name: 6-(1,3-benzoxazol-2-ylsulfanylmethyl)-N2-(4-fluorophenyl)-1,3,5-triazine-2,4-diamine Openeye Name: 6-(1,3-benzoxazol-2-ylsulfanylmethyl)-N2-(4-fluorophenyl)-1,3,5-triazine-2,4-diamine CAS Name: 6-[(1,3-benzoxazol-2-ylthio)methyl]-N2-(4-fluorophenyl)-1,3,5-triazine-2,4-diamine IUPAC Name: 6-(1,3-benzoxazol-2-ylsulfanylmethyl)-2-N-(4-fluorophenyl)-1,3,5-triazine-2,4-diamine Traditional Name: [4-amino-6-[(1,3-benzoxazol-2-ylthio)methyl]-s-triazin-2-yl]-(4-fluorophenyl)amine Formula: C17H13FN6OS MolecularWeight: 368.388123

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(O2)SCC3=NC(=NC(=N3)NC4=CC=C(C=C4)F)N

Isomeric SMILES

C1=CC=C2C(=C1)N=C(O2)SCC3=NC(=NC(=N3)NC4=CC=C(C=C4)F)N

InChI

InChI=1S/C17H13FN6OS/c18-10-5-7-11(8-6-10)20-16-23-14(22-15(19)24-16)9-26-17-21-12-3-1-2-4-13(12)25-17/h1-8H,9H2,(H3,19,20,22,23,24)