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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1C(C)C)SCC2=CC=CC=C2F

Isomeric SMILES

CC1=NN=C(N1C(C)C)SCC2=CC=CC=C2F

InChI

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