3-butylsulfanyl-4-(4-fluorophenyl)-5-phenyl-1,2,4-triazole

Systemtic Name: 3-butylsulfanyl-4-(4-fluorophenyl)-5-phenyl-1,2,4-triazole Openeye Name: 3-butylsulfanyl-4-(4-fluorophenyl)-5-phenyl-1,2,4-triazole CAS Name: 3-(butylthio)-4-(4-fluorophenyl)-5-phenyl-1,2,4-triazole IUPAC Name: 3-butylsulfanyl-4-(4-fluorophenyl)-5-phenyl-1,2,4-triazole Traditional Name: 3-(butylthio)-4-(4-fluorophenyl)-5-phenyl-1,2,4-triazole Formula: C18H18FN3S MolecularWeight: 327.419023

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=NN=C(N1C2=CC=C(C=C2)F)C3=CC=CC=C3

Isomeric SMILES

CCCCSC1=NN=C(N1C2=CC=C(C=C2)F)C3=CC=CC=C3

InChI

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