3-[4-azanyl-5-[(3-fluoranyl-4-methoxy-phenyl)methylsulfanyl]-1,2,4-triazol-3-yl]-N,N-diethyl-benzenesulfonamide

Systemtic Name: 3-[4-azanyl-5-[(3-fluoranyl-4-methoxy-phenyl)methylsulfanyl]-1,2,4-triazol-3-yl]-N,N-diethyl-benzenesulfonamide Openeye Name: 3-[4-amino-5-[(3-fluoro-4-methoxy-phenyl)methylsulfanyl]-1,2,4-triazol-3-yl]-N,N-diethyl-benzenesulfonamide CAS Name: 3-[4-amino-5-[(3-fluoro-4-methoxyphenyl)methylthio]-1,2,4-triazol-3-yl]-N,N-diethylbenzenesulfonamide IUPAC Name: 3-[4-amino-5-[(3-fluoro-4-methoxyphenyl)methylsulfanyl]-1,2,4-triazol-3-yl]-N,N-diethylbenzenesulfonamide Traditional Name: 3-[4-amino-5-[(3-fluoro-4-methoxy-benzyl)thio]-1,2,4-triazol-3-yl]-N,N-diethyl-benzenesulfonamide Formula: C20H24FN5O3S2 MolecularWeight: 465.564663

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC=CC(=C1)C2=NN=C(N2N)SCC3=CC(=C(C=C3)OC)F

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC=CC(=C1)C2=NN=C(N2N)SCC3=CC(=C(C=C3)OC)F

InChI

InChI=1S/C20H24FN5O3S2/c1-4-25(5-2)31(27,28)16-8-6-7-15(12-16)19-23-24-20(26(19)22)30-13-14-9-10-18(29-3)17(21)11-14/h6-12H,4-5,13,22H2,1-3H3