3-(4-fluorophenyl)-5-[1-(3-nitrophenyl)ethylsulfanyl]-1,2,4-triazol-4-amine

Systemtic Name: 3-(4-fluorophenyl)-5-[1-(3-nitrophenyl)ethylsulfanyl]-1,2,4-triazol-4-amine Openeye Name: 3-(4-fluorophenyl)-5-[1-(3-nitrophenyl)ethylsulfanyl]-1,2,4-triazol-4-amine CAS Name: 3-(4-fluorophenyl)-5-[1-(3-nitrophenyl)ethylthio]-1,2,4-triazol-4-amine IUPAC Name: 3-(4-fluorophenyl)-5-[1-(3-nitrophenyl)ethylsulfanyl]-1,2,4-triazol-4-amine Traditional Name: [3-(4-fluorophenyl)-5-[1-(3-nitrophenyl)ethylthio]-1,2,4-triazol-4-yl]amine Formula: C16H14FN5O2S MolecularWeight: 359.378063

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=CC=C1)[N+](=O)[O-])SC2=NN=C(N2N)C3=CC=C(C=C3)F

Isomeric SMILES

CC(C1=CC(=CC=C1)[N+](=O)[O-])SC2=NN=C(N2N)C3=CC=C(C=C3)F

InChI

InChI=1S/C16H14FN5O2S/c1-10(12-3-2-4-14(9-12)22(23)24)25-16-20-19-15(21(16)18)11-5-7-13(17)8-6-11/h2-10H,18H2,1H3