4-(4-butylphenyl)-3-(2-fluorophenyl)-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-(4-butylphenyl)-3-(2-fluorophenyl)-1H-1,2,4-triazole-5-thione Openeye Name: 4-(4-butylphenyl)-3-(2-fluorophenyl)-1H-1,2,4-triazole-5-thione CAS Name: 4-(4-butylphenyl)-3-(2-fluorophenyl)-1H-1,2,4-triazole-5-thione IUPAC Name: 4-(4-butylphenyl)-3-(2-fluorophenyl)-1H-1,2,4-triazole-5-thione Traditional Name: 4-(4-butylphenyl)-3-(2-fluorophenyl)-1H-1,2,4-triazole-5-thione Formula: C18H18FN3S MolecularWeight: 327.419023

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)N2C(=NNC2=S)C3=CC=CC=C3F

Isomeric SMILES

CCCCC1=CC=C(C=C1)N2C(=NNC2=S)C3=CC=CC=C3F

InChI

InChI=1S/C18H18FN3S/c1-2-3-6-13-9-11-14(12-10-13)22-17(20-21-18(22)23)15-7-4-5-8-16(15)19/h4-5,7-12H,2-3,6H2,1H3,(H,21,23)