3-[(4-tert-butylphenyl)methylsulfanyl]-4-cyclopropyl-5-(2-fluorophenyl)-1,2,4-triazole

Systemtic Name: 3-[(4-tert-butylphenyl)methylsulfanyl]-4-cyclopropyl-5-(2-fluorophenyl)-1,2,4-triazole Openeye Name: 3-[(4-tert-butylphenyl)methylsulfanyl]-4-cyclopropyl-5-(2-fluorophenyl)-1,2,4-triazole CAS Name: 3-[(4-tert-butylphenyl)methylthio]-4-cyclopropyl-5-(2-fluorophenyl)-1,2,4-triazole IUPAC Name: 3-[(4-tert-butylphenyl)methylsulfanyl]-4-cyclopropyl-5-(2-fluorophenyl)-1,2,4-triazole Traditional Name: 3-[(4-tert-butylbenzyl)thio]-4-cyclopropyl-5-(2-fluorophenyl)-1,2,4-triazole Formula: C22H24FN3S MolecularWeight: 381.509463

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CSC2=NN=C(N2C3CC3)C4=CC=CC=C4F

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CSC2=NN=C(N2C3CC3)C4=CC=CC=C4F

InChI

InChI=1S/C22H24FN3S/c1-22(2,3)16-10-8-15(9-11-16)14-27-21-25-24-20(26(21)17-12-13-17)18-6-4-5-7-19(18)23/h4-11,17H,12-14H2,1-3H3