2-[[3,5-bis(fluoranyl)phenyl]methyl]-1H-1,2,4-triazole-3-thione

Systemtic Name: 2-[[3,5-bis(fluoranyl)phenyl]methyl]-1H-1,2,4-triazole-3-thione Openeye Name: 2-[(3,5-difluorophenyl)methyl]-1H-1,2,4-triazole-3-thione CAS Name: 2-[(3,5-difluorophenyl)methyl]-1H-1,2,4-triazole-3-thione IUPAC Name: 2-[(3,5-difluorophenyl)methyl]-1H-1,2,4-triazole-3-thione Traditional Name: 2-(3,5-difluorobenzyl)-1H-1,2,4-triazole-3-thione Formula: C9H7F2N3S MolecularWeight: 227.233786

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C=C1F)F)CN2C(=S)N=CN2

Isomeric SMILES

C1=C(C=C(C=C1F)F)CN2C(=S)N=CN2

InChI

InChI=1S/C9H7F2N3S/c10-7-1-6(2-8(11)3-7)4-14-9(15)12-5-13-14/h1-3,5H,4H2,(H,12,13,15)