3-[(4-fluorophenyl)methylsulfanyl]-4-methyl-5-propan-2-yl-1,2,4-triazole

Systemtic Name: 3-[(4-fluorophenyl)methylsulfanyl]-4-methyl-5-propan-2-yl-1,2,4-triazole Openeye Name: 3-[(4-fluorophenyl)methylsulfanyl]-5-isopropyl-4-methyl-1,2,4-triazole CAS Name: 3-[(4-fluorophenyl)methylthio]-4-methyl-5-propan-2-yl-1,2,4-triazole IUPAC Name: 3-[(4-fluorophenyl)methylsulfanyl]-4-methyl-5-propan-2-yl-1,2,4-triazole Traditional Name: 3-[(4-fluorobenzyl)thio]-5-isopropyl-4-methyl-1,2,4-triazole Formula: C13H16FN3S MolecularWeight: 265.349643

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NN=C(N1C)SCC2=CC=C(C=C2)F

Isomeric SMILES

CC(C)C1=NN=C(N1C)SCC2=CC=C(C=C2)F

InChI

InChI=1S/C13H16FN3S/c1-9(2)12-15-16-13(17(12)3)18-8-10-4-6-11(14)7-5-10/h4-7,9H,8H2,1-3H3