3-cyclohexyl-5-[(3-fluoranyl-4-methoxy-phenyl)methylsulfanyl]-4-prop-2-enyl-1,2,4-triazole

Systemtic Name: 3-cyclohexyl-5-[(3-fluoranyl-4-methoxy-phenyl)methylsulfanyl]-4-prop-2-enyl-1,2,4-triazole Openeye Name: 4-allyl-3-cyclohexyl-5-[(3-fluoro-4-methoxy-phenyl)methylsulfanyl]-1,2,4-triazole CAS Name: 3-cyclohexyl-5-[(3-fluoro-4-methoxyphenyl)methylthio]-4-prop-2-enyl-1,2,4-triazole IUPAC Name: 3-cyclohexyl-5-[(3-fluoro-4-methoxyphenyl)methylsulfanyl]-4-prop-2-enyl-1,2,4-triazole Traditional Name: 4-allyl-3-cyclohexyl-5-[(3-fluoro-4-methoxy-benzyl)thio]-1,2,4-triazole Formula: C19H24FN3OS MolecularWeight: 361.476763

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CSC2=NN=C(N2CC=C)C3CCCCC3)F

Isomeric SMILES

COC1=C(C=C(C=C1)CSC2=NN=C(N2CC=C)C3CCCCC3)F

InChI

InChI=1S/C19H24FN3OS/c1-3-11-23-18(15-7-5-4-6-8-15)21-22-19(23)25-13-14-9-10-17(24-2)16(20)12-14/h3,9-10,12,15H,1,4-8,11,13H2,2H3