4-butyl-3-[[(4-fluorophenyl)amino]methyl]-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-butyl-3-[[(4-fluorophenyl)amino]methyl]-1H-1,2,4-triazole-5-thione Openeye Name: 4-butyl-3-[(4-fluoroanilino)methyl]-1H-1,2,4-triazole-5-thione CAS Name: 4-butyl-3-[(4-fluoroanilino)methyl]-1H-1,2,4-triazole-5-thione IUPAC Name: 4-butyl-3-[(4-fluoroanilino)methyl]-1H-1,2,4-triazole-5-thione Traditional Name: 4-butyl-3-[(4-fluoroanilino)methyl]-1H-1,2,4-triazole-5-thione Formula: C13H17FN4S MolecularWeight: 280.364283

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=NNC1=S)CNC2=CC=C(C=C2)F

Isomeric SMILES

CCCCN1C(=NNC1=S)CNC2=CC=C(C=C2)F

InChI

InChI=1S/C13H17FN4S/c1-2-3-8-18-12(16-17-13(18)19)9-15-11-6-4-10(14)5-7-11/h4-7,15H,2-3,8-9H2,1H3,(H,17,19)