3-[4-[bis(fluoranyl)methoxy]phenyl]-5-phenethylsulfanyl-1,2,4-triazol-4-amine

Systemtic Name: 3-[4-[bis(fluoranyl)methoxy]phenyl]-5-phenethylsulfanyl-1,2,4-triazol-4-amine Openeye Name: 3-[4-(difluoromethoxy)phenyl]-5-phenethylsulfanyl-1,2,4-triazol-4-amine CAS Name: 3-[4-(difluoromethoxy)phenyl]-5-(phenethylthio)-1,2,4-triazol-4-amine IUPAC Name: 3-[4-(difluoromethoxy)phenyl]-5-phenethylsulfanyl-1,2,4-triazol-4-amine Traditional Name: [3-[4-(difluoromethoxy)phenyl]-5-(phenethylthio)-1,2,4-triazol-4-yl]amine Formula: C17H16F2N4OS MolecularWeight: 362.396946

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCSC2=NN=C(N2N)C3=CC=C(C=C3)OC(F)F

Isomeric SMILES

C1=CC=C(C=C1)CCSC2=NN=C(N2N)C3=CC=C(C=C3)OC(F)F

InChI

InChI=1S/C17H16F2N4OS/c18-16(19)24-14-8-6-13(7-9-14)15-21-22-17(23(15)20)25-11-10-12-4-2-1-3-5-12/h1-9,16H,10-11,20H2