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

Systemtic Name: 4-ethyl-3-[(3-fluorophenyl)methylsulfanyl]-5-propan-2-yl-1,2,4-triazole Openeye Name: 4-ethyl-3-[(3-fluorophenyl)methylsulfanyl]-5-isopropyl-1,2,4-triazole CAS Name: 4-ethyl-3-[(3-fluorophenyl)methylthio]-5-propan-2-yl-1,2,4-triazole IUPAC Name: 4-ethyl-3-[(3-fluorophenyl)methylsulfanyl]-5-propan-2-yl-1,2,4-triazole Traditional Name: 4-ethyl-3-[(3-fluorobenzyl)thio]-5-isopropyl-1,2,4-triazole Formula: C14H18FN3S MolecularWeight: 279.376223

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC2=CC(=CC=C2)F)C(C)C

Isomeric SMILES

CCN1C(=NN=C1SCC2=CC(=CC=C2)F)C(C)C

InChI

InChI=1S/C14H18FN3S/c1-4-18-13(10(2)3)16-17-14(18)19-9-11-6-5-7-12(15)8-11/h5-8,10H,4,9H2,1-3H3