4-ethyl-3-(furan-2-yl)-5-[(4-pyrazol-1-ylphenyl)methylsulfanyl]-1,2,4-triazole

Systemtic Name: 4-ethyl-3-(furan-2-yl)-5-[(4-pyrazol-1-ylphenyl)methylsulfanyl]-1,2,4-triazole Openeye Name: 4-ethyl-3-(2-furyl)-5-[(4-pyrazol-1-ylphenyl)methylsulfanyl]-1,2,4-triazole CAS Name: 4-ethyl-3-(2-furanyl)-5-[[4-(1-pyrazolyl)phenyl]methylthio]-1,2,4-triazole IUPAC Name: 4-ethyl-3-(furan-2-yl)-5-[(4-pyrazol-1-ylphenyl)methylsulfanyl]-1,2,4-triazole Traditional Name: 4-ethyl-3-(2-furyl)-5-[(4-pyrazol-1-ylbenzyl)thio]-1,2,4-triazole Formula: C18H17N5OS MolecularWeight: 351.42548

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC2=CC=C(C=C2)N3C=CC=N3)C4=CC=CO4

Isomeric SMILES

CCN1C(=NN=C1SCC2=CC=C(C=C2)N3C=CC=N3)C4=CC=CO4

InChI

InChI=1S/C18H17N5OS/c1-2-22-17(16-5-3-12-24-16)20-21-18(22)25-13-14-6-8-15(9-7-14)23-11-4-10-19-23/h3-12H,2,13H2,1H3