3-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanyl]-5-(2-phenylcyclopropyl)-4-prop-2-enyl-1,2,4-triazole

Systemtic Name: 3-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanyl]-5-(2-phenylcyclopropyl)-4-prop-2-enyl-1,2,4-triazole Openeye Name: 4-allyl-3-[(2-chloro-6-fluoro-phenyl)methylsulfanyl]-5-(2-phenylcyclopropyl)-1,2,4-triazole CAS Name: 3-[(2-chloro-6-fluorophenyl)methylthio]-5-(2-phenylcyclopropyl)-4-prop-2-enyl-1,2,4-triazole IUPAC Name: 3-[(2-chloro-6-fluorophenyl)methylsulfanyl]-5-(2-phenylcyclopropyl)-4-prop-2-enyl-1,2,4-triazole Traditional Name: 4-allyl-3-[(2-chloro-6-fluoro-benzyl)thio]-5-(2-phenylcyclopropyl)-1,2,4-triazole Formula: C21H19ClFN3S MolecularWeight: 399.912063

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=NN=C1SCC2=C(C=CC=C2Cl)F)C3CC3C4=CC=CC=C4

Isomeric SMILES

C=CCN1C(=NN=C1SCC2=C(C=CC=C2Cl)F)C3CC3C4=CC=CC=C4

InChI

InChI=1S/C21H19ClFN3S/c1-2-11-26-20(16-12-15(16)14-7-4-3-5-8-14)24-25-21(26)27-13-17-18(22)9-6-10-19(17)23/h2-10,15-16H,1,11-13H2