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

Systemtic Name: 4-azanyl-3-[[3,5-bis(fluoranyl)phenyl]methyl]-1H-1,2,4-triazole-5-thione Openeye Name: 4-amino-3-[(3,5-difluorophenyl)methyl]-1H-1,2,4-triazole-5-thione CAS Name: 4-amino-3-[(3,5-difluorophenyl)methyl]-1H-1,2,4-triazole-5-thione IUPAC Name: 4-amino-3-[(3,5-difluorophenyl)methyl]-1H-1,2,4-triazole-5-thione Traditional Name: 4-amino-3-(3,5-difluorobenzyl)-1H-1,2,4-triazole-5-thione Formula: C9H8F2N4S MolecularWeight: 242.248426

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C=C1F)F)CC2=NNC(=S)N2N

Isomeric SMILES

C1=C(C=C(C=C1F)F)CC2=NNC(=S)N2N

InChI

InChI=1S/C9H8F2N4S/c10-6-1-5(2-7(11)4-6)3-8-13-14-9(16)15(8)12/h1-2,4H,3,12H2,(H,14,16)