3-[5-[(4-fluorophenyl)methylsulfanyl]-4-prop-2-enyl-1,2,4-triazol-3-yl]-5-phenyl-thiophen-2-amine

Systemtic Name: 3-[5-[(4-fluorophenyl)methylsulfanyl]-4-prop-2-enyl-1,2,4-triazol-3-yl]-5-phenyl-thiophen-2-amine Openeye Name: 3-[4-allyl-5-[(4-fluorophenyl)methylsulfanyl]-1,2,4-triazol-3-yl]-5-phenyl-thiophen-2-amine CAS Name: 3-[5-[(4-fluorophenyl)methylthio]-4-prop-2-enyl-1,2,4-triazol-3-yl]-5-phenyl-2-thiophenamine IUPAC Name: 3-[5-[(4-fluorophenyl)methylsulfanyl]-4-prop-2-enyl-1,2,4-triazol-3-yl]-5-phenylthiophen-2-amine Traditional Name: [3-[4-allyl-5-[(4-fluorobenzyl)thio]-1,2,4-triazol-3-yl]-5-phenyl-2-thienyl]amine Formula: C22H19FN4S2 MolecularWeight: 422.541463

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=NN=C1SCC2=CC=C(C=C2)F)C3=C(SC(=C3)C4=CC=CC=C4)N

Isomeric SMILES

C=CCN1C(=NN=C1SCC2=CC=C(C=C2)F)C3=C(SC(=C3)C4=CC=CC=C4)N

InChI

InChI=1S/C22H19FN4S2/c1-2-12-27-21(18-13-19(29-20(18)24)16-6-4-3-5-7-16)25-26-22(27)28-14-15-8-10-17(23)11-9-15/h2-11,13H,1,12,14,24H2