1-[2-(2-fluoranyl-4-methyl-phenyl)-3-iodanyl-propyl]-1,2,4-triazole

Systemtic Name: 1-[2-(2-fluoranyl-4-methyl-phenyl)-3-iodanyl-propyl]-1,2,4-triazole Openeye Name: 1-[2-(2-fluoro-4-methyl-phenyl)-3-iodo-propyl]-1,2,4-triazole CAS Name: 1-[2-(2-fluoro-4-methylphenyl)-3-iodopropyl]-1,2,4-triazole IUPAC Name: 1-[2-(2-fluoro-4-methylphenyl)-3-iodopropyl]-1,2,4-triazole Traditional Name: 1-[2-(2-fluoro-4-methyl-phenyl)-3-iodo-propyl]-1,2,4-triazole Formula: C12H13FIN3 MolecularWeight: 345.154593

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(CN2C=NC=N2)CI)F

Isomeric SMILES

CC1=CC(=C(C=C1)C(CN2C=NC=N2)CI)F

InChI

InChI=1S/C12H13FIN3/c1-9-2-3-11(12(13)4-9)10(5-14)6-17-8-15-7-16-17/h2-4,7-8,10H,5-6H2,1H3