3-[(2-chloranyl-4-fluoranyl-phenyl)methylsulfanyl]-4-ethyl-5-(3-methylphenyl)-1,2,4-triazole

Systemtic Name: 3-[(2-chloranyl-4-fluoranyl-phenyl)methylsulfanyl]-4-ethyl-5-(3-methylphenyl)-1,2,4-triazole Openeye Name: 3-[(2-chloro-4-fluoro-phenyl)methylsulfanyl]-4-ethyl-5-(m-tolyl)-1,2,4-triazole CAS Name: 3-[(2-chloro-4-fluorophenyl)methylthio]-4-ethyl-5-(3-methylphenyl)-1,2,4-triazole IUPAC Name: 3-[(2-chloro-4-fluorophenyl)methylsulfanyl]-4-ethyl-5-(3-methylphenyl)-1,2,4-triazole Traditional Name: 3-[(2-chloro-4-fluoro-benzyl)thio]-4-ethyl-5-(m-tolyl)-1,2,4-triazole Formula: C18H17ClFN3S MolecularWeight: 361.864083

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC2=C(C=C(C=C2)F)Cl)C3=CC(=CC=C3)C

Isomeric SMILES

CCN1C(=NN=C1SCC2=C(C=C(C=C2)F)Cl)C3=CC(=CC=C3)C

InChI

InChI=1S/C18H17ClFN3S/c1-3-23-17(13-6-4-5-12(2)9-13)21-22-18(23)24-11-14-7-8-15(20)10-16(14)19/h4-10H,3,11H2,1-2H3