4-cyclopropyl-3-(2-fluorophenyl)-5-[(4-pyrazol-1-ylphenyl)methylsulfanyl]-1,2,4-triazole

Systemtic Name: 4-cyclopropyl-3-(2-fluorophenyl)-5-[(4-pyrazol-1-ylphenyl)methylsulfanyl]-1,2,4-triazole Openeye Name: 4-cyclopropyl-3-(2-fluorophenyl)-5-[(4-pyrazol-1-ylphenyl)methylsulfanyl]-1,2,4-triazole CAS Name: 4-cyclopropyl-3-(2-fluorophenyl)-5-[[4-(1-pyrazolyl)phenyl]methylthio]-1,2,4-triazole IUPAC Name: 4-cyclopropyl-3-(2-fluorophenyl)-5-[(4-pyrazol-1-ylphenyl)methylsulfanyl]-1,2,4-triazole Traditional Name: 4-cyclopropyl-3-(2-fluorophenyl)-5-[(4-pyrazol-1-ylbenzyl)thio]-1,2,4-triazole Formula: C21H18FN5S MolecularWeight: 391.464523

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C(=NN=C2SCC3=CC=C(C=C3)N4C=CC=N4)C5=CC=CC=C5F

Isomeric SMILES

C1CC1N2C(=NN=C2SCC3=CC=C(C=C3)N4C=CC=N4)C5=CC=CC=C5F

InChI

InChI=1S/C21H18FN5S/c22-19-5-2-1-4-18(19)20-24-25-21(27(20)17-10-11-17)28-14-15-6-8-16(9-7-15)26-13-3-12-23-26/h1-9,12-13,17H,10-11,14H2