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

Systemtic Name: 3-cyclopropyl-5-[(3-fluoranyl-4-methoxy-phenyl)methylsulfanyl]-4-phenyl-1,2,4-triazole Openeye Name: 3-cyclopropyl-5-[(3-fluoro-4-methoxy-phenyl)methylsulfanyl]-4-phenyl-1,2,4-triazole CAS Name: 3-cyclopropyl-5-[(3-fluoro-4-methoxyphenyl)methylthio]-4-phenyl-1,2,4-triazole IUPAC Name: 3-cyclopropyl-5-[(3-fluoro-4-methoxyphenyl)methylsulfanyl]-4-phenyl-1,2,4-triazole Traditional Name: 3-cyclopropyl-5-[(3-fluoro-4-methoxy-benzyl)thio]-4-phenyl-1,2,4-triazole Formula: C19H18FN3OS MolecularWeight: 355.429123

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CSC2=NN=C(N2C3=CC=CC=C3)C4CC4)F

Isomeric SMILES

COC1=C(C=C(C=C1)CSC2=NN=C(N2C3=CC=CC=C3)C4CC4)F

InChI

InChI=1S/C19H18FN3OS/c1-24-17-10-7-13(11-16(17)20)12-25-19-22-21-18(14-8-9-14)23(19)15-5-3-2-4-6-15/h2-7,10-11,14H,8-9,12H2,1H3