3-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanyl]-4-cyclohexyl-5-(naphthalen-1-ylmethyl)-1,2,4-triazole

Systemtic Name: 3-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanyl]-4-cyclohexyl-5-(naphthalen-1-ylmethyl)-1,2,4-triazole Openeye Name: 3-[(2-chloro-6-fluoro-phenyl)methylsulfanyl]-4-cyclohexyl-5-(1-naphthylmethyl)-1,2,4-triazole CAS Name: 3-[(2-chloro-6-fluorophenyl)methylthio]-4-cyclohexyl-5-(1-naphthalenylmethyl)-1,2,4-triazole IUPAC Name: 3-[(2-chloro-6-fluorophenyl)methylsulfanyl]-4-cyclohexyl-5-(naphthalen-1-ylmethyl)-1,2,4-triazole Traditional Name: 3-[(2-chloro-6-fluoro-benzyl)thio]-4-cyclohexyl-5-(1-naphthylmethyl)-1,2,4-triazole Formula: C26H25ClFN3S MolecularWeight: 466.013203

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C(=NN=C2SCC3=C(C=CC=C3Cl)F)CC4=CC=CC5=CC=CC=C54

Isomeric SMILES

C1CCC(CC1)N2C(=NN=C2SCC3=C(C=CC=C3Cl)F)CC4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C26H25ClFN3S/c27-23-14-7-15-24(28)22(23)17-32-26-30-29-25(31(26)20-11-2-1-3-12-20)16-19-10-6-9-18-8-4-5-13-21(18)19/h4-10,13-15,20H,1-3,11-12,16-17H2