3-butylsulfanyl-5-ethyl-4-phenyl-1,2,4-triazole

Systemtic Name: 3-butylsulfanyl-5-ethyl-4-phenyl-1,2,4-triazole Openeye Name: 3-butylsulfanyl-5-ethyl-4-phenyl-1,2,4-triazole CAS Name: 3-(butylthio)-5-ethyl-4-phenyl-1,2,4-triazole IUPAC Name: 3-butylsulfanyl-5-ethyl-4-phenyl-1,2,4-triazole Traditional Name: 3-(butylthio)-5-ethyl-4-phenyl-1,2,4-triazole Formula: C14H19N3S MolecularWeight: 261.38576

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H19N3S/c1-3-5-11-18-14-16-15-13(4-2)17(14)12-9-7-6-8-10-12/h6-10H,3-5,11H2,1-2H3