5-[6-[2,4-bis(fluoranyl)phenyl]-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-3-yl]pentylazanium

Systemtic Name: 5-[6-[2,4-bis(fluoranyl)phenyl]-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-3-yl]pentylazanium Openeye Name: 5-[6-(2,4-difluorophenyl)-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-3-yl]pentylammonium CAS Name: 5-[6-(2,4-difluorophenyl)-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-3-yl]pentylammonium IUPAC Name: 5-[6-(2,4-difluorophenyl)-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-3-yl]pentylazanium Traditional Name: 5-[6-(2,4-difluorophenyl)-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-3-yl]pentylammonium Formula: C15H18F2N5S+ MolecularWeight: 338.398726

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1F)F)C2=CSC3=NN=C(N3N2)CCCCC[NH3+]

Isomeric SMILES

C1=CC(=C(C=C1F)F)C2=CSC3=NN=C(N3N2)CCCCC[NH3+]

InChI

InChI=1S/C15H17F2N5S/c16-10-5-6-11(12(17)8-10)13-9-23-15-20-19-14(22(15)21-13)4-2-1-3-7-18/h5-6,8-9,21H,1-4,7,18H2/p+1