3-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-4-(furan-2-ylmethyl)-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-4-(furan-2-ylmethyl)-1H-1,2,4-triazole-5-thione Openeye Name: 3-[(2-chloro-6-fluoro-phenyl)methyl]-4-(2-furylmethyl)-1H-1,2,4-triazole-5-thione CAS Name: 3-[(2-chloro-6-fluorophenyl)methyl]-4-(2-furanylmethyl)-1H-1,2,4-triazole-5-thione IUPAC Name: 3-[(2-chloro-6-fluorophenyl)methyl]-4-(furan-2-ylmethyl)-1H-1,2,4-triazole-5-thione Traditional Name: 3-(2-chloro-6-fluoro-benzyl)-4-(2-furfuryl)-1H-1,2,4-triazole-5-thione Formula: C14H11ClFN3OS MolecularWeight: 323.773043

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)Cl)CC2=NNC(=S)N2CC3=CC=CO3)F

Isomeric SMILES

C1=CC(=C(C(=C1)Cl)CC2=NNC(=S)N2CC3=CC=CO3)F

InChI

InChI=1S/C14H11ClFN3OS/c15-11-4-1-5-12(16)10(11)7-13-17-18-14(21)19(13)8-9-3-2-6-20-9/h1-6H,7-8H2,(H,18,21)